data_1gau_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 1gau _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.946 0 CA-C-O 121.263 0.554 . . . . 0.0 109.619 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.32 -31.77 7.8 Favored Glycine 0 N--CA 1.494 2.549 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.448 HG22 ' CH2' ' A' ' 18' ' ' TRP . 3.5 m -63.5 91.69 0.06 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.343 -1.092 . . . . 0.0 109.137 178.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 6' ' ' VAL . 12.4 m -88.93 122.17 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.509 ' CB ' HG23 ' A' ' 12' ' ' THR . 49.5 t -49.57 118.06 2.57 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.336 -0.853 . . . . 0.0 110.602 -178.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.1 m -65.33 -7.71 14.81 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.411 -0.806 . . . . 0.0 111.115 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -107.78 -23.64 12.0 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 120.732 -1.23 . . . . 0.0 110.858 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.516 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 14.0 p -145.41 20.63 1.53 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.669 -1.269 . . . . 0.0 111.176 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER 45.05 20.31 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.451 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 178.71 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.509 HG23 ' CB ' ' A' ' 7' ' ' CYS . 14.1 t -77.4 135.78 38.35 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.34 -1.475 . . . . 0.0 109.655 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.3 p -95.0 -21.37 18.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.536 -0.728 . . . . 0.0 109.347 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.48 ' HB ' HG13 ' A' ' 51' ' ' ILE . 72.3 p -109.45 120.31 42.1 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.249 -0.907 . . . . 0.0 109.772 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.572 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 4.4 p -135.71 159.77 40.62 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.279 -0.888 . . . . 0.0 109.591 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.0 p -83.54 -30.77 26.81 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.562 -0.711 . . . . 0.0 109.205 179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.588 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 45.9 mt -142.13 91.3 2.33 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.345 -0.847 . . . . 0.0 109.371 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.458 ' CZ2' HG23 ' A' ' 15' ' ' THR . 18.5 m95 -64.2 109.1 1.75 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.296 -0.877 . . . . 0.0 109.806 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.54 ' HG3' ' O ' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -98.85 130.32 45.26 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.224 -0.922 . . . . 0.0 109.403 179.651 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.8 mmm180 -96.38 119.8 35.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.16 -0.963 . . . . 0.0 109.745 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.6 t -79.21 142.8 59.56 Favored Pre-proline 0 N--CA 1.499 2.018 0 O-C-N 121.206 -0.934 . . . . 0.0 109.478 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -54.32 -41.61 74.87 Favored 'Trans proline' 0 C--N 1.32 -0.959 0 C-N-CA 122.655 2.237 . . . . 0.0 111.0 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.7 mtm -62.05 -21.06 64.61 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.268 -0.895 . . . . 0.0 109.412 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.02 44.66 1.08 Allowed Glycine 0 N--CA 1.497 2.753 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -129.28 98.94 22.14 Favored Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.155 -1.203 . . . . 0.0 110.822 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -65.97 107.09 1.06 Allowed 'Trans proline' 0 C--N 1.314 -1.247 0 C-N-CA 122.101 1.867 . . . . 0.0 109.241 178.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.54 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 2.0 m -122.88 126.28 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 O-C-N 121.135 -0.978 . . . . 0.0 110.506 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.572 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.2 p -48.06 131.12 15.87 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.404 -0.81 . . . . 0.0 109.839 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.588 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 5.6 t-20 -35.09 -43.68 0.21 Allowed 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.837 -0.54 . . . . 0.0 112.156 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.43 -45.42 62.63 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.276 -0.89 . . . . 0.0 110.606 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.447 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 18.6 m -64.75 -37.44 87.59 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.331 -0.856 . . . . 0.0 108.999 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.29 -53.53 25.05 Favored Glycine 0 N--CA 1.495 2.602 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.518 ' O ' HD13 ' A' ' 37' ' ' LEU . 93.7 mt -55.74 -58.44 7.81 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.503 -0.998 . . . . 0.0 109.877 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.488 ' CZ ' ' HD2' ' A' ' 43' ' ' PRO . 11.4 t80 -47.28 -42.62 21.24 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.489 -0.757 . . . . 0.0 109.749 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.424 ' O ' ' HA ' ' A' ' 39' ' ' GLN . 40.4 t80 -52.29 -46.99 66.13 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.374 -0.829 . . . . 0.0 109.979 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.4 -38.1 77.8 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 120.82 -1.175 . . . . 0.0 110.206 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 33' ' ' LEU . 6.0 mp -42.97 -52.46 5.19 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.565 -0.709 . . . . 0.0 110.16 -179.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.451 ' CB ' HG21 ' A' ' 40' ' ' VAL . 78.6 m-70 -121.37 12.13 10.84 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.18 -0.95 . . . . 0.0 110.082 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.424 ' HA ' ' O ' ' A' ' 35' ' ' TYR . 8.4 tt0 50.13 34.92 9.13 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.356 -0.84 . . . . 0.0 110.141 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.451 HG21 ' CB ' ' A' ' 38' ' ' HIS . 2.9 m -135.96 -165.42 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 O-C-N 121.313 -0.867 . . . . 0.0 109.203 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.7 p30 -62.93 -173.82 0.06 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.224 -0.922 . . . . 0.0 110.254 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.447 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -146.41 106.97 4.11 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.283 -0.885 . . . . 0.0 109.884 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.488 ' HD2' ' CZ ' ' A' ' 34' ' ' TYR . 3.5 Cg_exo -60.34 128.01 24.8 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 C-N-CA 122.234 1.956 . . . . 0.0 110.08 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.516 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.9 OUTLIER -93.3 25.48 3.34 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.335 -0.853 . . . . 0.0 110.884 -179.299 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -6.91 29.67 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.031 -1.043 . . . . 0.0 110.849 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 57.8 mtm -102.93 -7.82 21.19 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.871 -1.143 . . . . 0.0 110.61 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.513 ' NH1' ' HG3' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -81.64 164.76 21.61 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.869 -1.144 . . . . 0.0 110.451 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.2 -169.12 3.23 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.365 -0.835 . . . . 0.0 109.719 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -78.84 -9.53 59.5 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.093 -1.004 . . . . 0.0 110.699 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -137.17 145.08 16.8 Favored Glycine 0 N--CA 1.499 2.882 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.48 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.1 mt -54.18 124.3 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.405 -1.056 . . . . 0.0 110.108 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.49 159.59 33.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.451 -0.781 . . . . 0.0 109.4 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.32 163.34 40.25 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.011 -1.055 . . . . 0.0 109.378 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -149.86 -163.26 1.74 Allowed 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.4 93.93 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.042 -1.036 . . . . 0.0 108.515 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.36 150.19 1.36 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.566 -0.709 . . . . 0.0 109.972 -179.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt . . . . . 0 N--CA 1.495 1.808 0 O-C-N 121.358 -0.839 . . . . 0.0 109.641 179.921 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.765 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.44 -30.44 3.45 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.369 -1.493 . . . . 0.0 109.369 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.475 HG23 ' CH2' ' A' ' 18' ' ' TRP . 72.8 m -72.09 86.15 1.04 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.088 -1.242 . . . . 0.0 109.316 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.3 m -88.46 112.81 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.531 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 52.9 t -47.99 108.05 0.15 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.466 -0.771 . . . . 0.0 110.732 -178.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.9 m -59.76 -14.96 16.84 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.309 -0.869 . . . . 0.0 111.129 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.511 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.9 OUTLIER -90.36 -30.11 17.63 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.032 -1.043 . . . . 0.0 110.739 -179.788 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.546 ' SG ' ' CG2' ' A' ' 12' ' ' THR . 16.3 p -143.25 23.81 1.82 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.627 -1.296 . . . . 0.0 110.908 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.474 ' N ' ' O ' ' A' ' 7' ' ' CYS . 7.1 mt-30 44.61 22.56 0.06 Allowed 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.354 -0.842 . . . . 0.0 112.201 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.546 ' CG2' ' SG ' ' A' ' 10' ' ' CYS . 6.7 t -89.19 125.63 35.15 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.515 -1.366 . . . . 0.0 110.051 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.6 t -90.96 -17.11 26.91 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.638 -0.664 . . . . 0.0 109.639 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.491 ' HB ' HG13 ' A' ' 51' ' ' ILE . 23.0 p -101.42 115.63 30.93 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.252 -0.905 . . . . 0.0 109.035 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.496 HG23 ' CZ3' ' A' ' 18' ' ' TRP . 6.9 p -135.44 153.17 51.86 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.218 -0.926 . . . . 0.0 110.211 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 40.7 p -83.43 -34.74 25.4 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.556 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 35.4 mt -137.61 96.96 3.34 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.475 -0.766 . . . . 0.0 109.312 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.496 ' CZ3' HG23 ' A' ' 15' ' ' THR . 8.6 m95 -62.93 110.96 1.95 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.153 -0.967 . . . . 0.0 109.843 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.34 104.51 14.13 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.358 -0.839 . . . . 0.0 109.237 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -73.21 115.14 12.19 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.098 . . . . 0.0 108.812 179.784 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.523 ' HB3' ' HG2' ' A' ' 23' ' ' MET . 0.2 OUTLIER -67.95 144.49 97.2 Favored Pre-proline 0 N--CA 1.5 2.064 0 O-C-N 121.21 -0.931 . . . . 0.0 110.293 -179.118 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -55.18 -40.84 83.68 Favored 'Trans proline' 0 C--N 1.319 -1.013 0 C-N-CA 122.867 2.378 . . . . 0.0 110.952 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.523 ' HG2' ' HB3' ' A' ' 21' ' ' SER . 1.4 ptt? -54.73 -23.8 19.34 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.401 -0.812 . . . . 0.0 109.986 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.57 37.18 1.47 Allowed Glycine 0 N--CA 1.497 2.713 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -136.23 116.19 11.13 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 120.864 -1.374 . . . . 0.0 110.322 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.43 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 5.1 Cg_exo -62.06 106.13 0.44 Allowed 'Trans proline' 0 C--N 1.316 -1.177 0 C-N-CA 122.321 2.014 . . . . 0.0 110.026 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.531 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.8 m -120.37 126.01 74.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.104 -0.997 . . . . 0.0 110.665 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.408 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 9.7 p -49.27 133.67 19.13 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 121.443 0.64 . . . . 0.0 109.456 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.556 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 8.1 t-20 -37.9 -45.43 0.86 Allowed 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.578 -0.701 . . . . 0.0 111.577 -178.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.71 -46.49 40.77 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.208 -0.933 . . . . 0.0 110.96 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 6.9 m -60.24 -47.05 87.62 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.44 -32.44 64.38 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 109.626 -1.389 . . . . 0.0 109.626 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.512 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 81.9 mt -75.85 -64.01 1.18 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.512 -0.993 . . . . 0.0 109.284 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.416 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 9.3 t80 -47.13 -38.71 12.02 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.055 -1.028 . . . . 0.0 109.143 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.438 ' O ' ' N ' ' A' ' 39' ' ' GLN . 31.5 t80 -60.18 -49.54 77.23 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.48 -0.763 . . . . 0.0 109.787 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.512 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -62.06 -25.5 67.72 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.671 -1.268 . . . . 0.0 110.671 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.497 HD11 ' O ' ' A' ' 33' ' ' LEU . 6.5 mp -62.19 -63.75 1.14 Allowed 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.206 -0.934 . . . . 0.0 110.268 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.529 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 69.8 m-70 -106.93 13.47 27.63 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.322 -0.862 . . . . 0.0 110.366 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER 42.98 33.02 0.46 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.679 -0.638 . . . . 0.0 111.219 -179.557 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' CZ ' ' A' ' 42' ' ' ARG . 5.4 m -136.01 164.72 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 O-C-N 121.15 -0.969 . . . . 0.0 110.176 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -84.45 136.31 33.9 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.438 -0.789 . . . . 0.0 108.974 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.492 ' CZ ' HG22 ' A' ' 40' ' ' VAL . 2.5 mpt_? -131.78 148.07 68.5 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 121.273 -0.892 . . . . 0.0 109.994 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -63.02 144.33 92.67 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 122.44 2.093 . . . . 0.0 111.011 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.539 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -84.49 41.63 0.85 Allowed 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.503 -0.748 . . . . 0.0 110.709 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.4 p -63.78 -17.32 62.95 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.136 -0.977 . . . . 0.0 110.373 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 32.6 ttp -97.45 -2.12 42.78 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.122 -0.986 . . . . 0.0 110.609 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.461 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 1.8 tpt180 -63.64 145.04 56.49 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 120.645 -1.285 . . . . 0.0 110.486 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.97 -176.27 2.86 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.405 -0.809 . . . . 0.0 109.943 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -78.45 -40.7 34.92 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.633 -0.667 . . . . 0.0 110.177 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.43 165.76 19.49 Favored Glycine 0 N--CA 1.5 2.937 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.491 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.8 mt -58.13 123.78 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.52 -0.988 . . . . 0.0 110.217 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.86 159.29 31.12 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.556 -0.715 . . . . 0.0 109.856 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.98 162.91 40.28 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.272 -0.892 . . . . 0.0 109.275 179.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.422 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -150.59 -161.82 1.42 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.703 -0.623 . . . . 0.0 109.323 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.74 91.83 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.003 -1.061 . . . . 0.0 108.716 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.43 130.69 16.87 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.602 -0.686 . . . . 0.0 110.215 -178.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.865 0 O-C-N 121.504 -0.748 . . . . 0.0 110.008 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.714 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.84 -45.7 1.14 Allowed Glycine 0 N--CA 1.494 2.563 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.428 ' HB ' ' CZ2' ' A' ' 18' ' ' TRP . 3.9 m -65.43 102.51 0.7 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.118 -1.225 . . . . 0.0 109.503 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.9 m -104.01 113.22 40.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 43.7 t -51.1 107.31 0.17 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 109.536 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.6 m -57.79 -17.77 17.79 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.099 -1.0 . . . . 0.0 110.918 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.442 ' HB2' HG11 ' A' ' 27' ' ' VAL . 3.0 m120 -86.14 -30.88 22.17 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.102 -0.999 . . . . 0.0 111.016 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.5 p -142.72 23.02 1.95 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.571 -1.33 . . . . 0.0 111.437 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.455 ' N ' ' O ' ' A' ' 7' ' ' CYS . 13.0 mm100 42.29 35.35 0.6 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.5 -0.75 . . . . 0.0 112.386 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.496 HG21 HG22 ' A' ' 15' ' ' THR . 5.2 t -90.56 135.47 33.68 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.643 -1.286 . . . . 0.0 109.671 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.4 p -93.72 -18.46 22.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.537 -0.727 . . . . 0.0 109.749 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.494 ' HB ' HG13 ' A' ' 51' ' ' ILE . 69.3 p -111.58 126.11 54.65 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.023 -1.048 . . . . 0.0 109.329 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.496 HG22 HG21 ' A' ' 12' ' ' THR . 11.9 p -138.44 151.79 47.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.206 -0.934 . . . . 0.0 110.496 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.461 ' CG2' HG23 ' A' ' 51' ' ' ILE . 73.3 p -77.1 -32.75 56.82 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.6 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 52.4 mt -146.46 110.14 4.88 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 179.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.429 ' CZ2' HG21 ' A' ' 15' ' ' THR . 13.2 m95 -72.29 120.25 17.63 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.088 -1.008 . . . . 0.0 110.373 -179.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -106.51 82.17 1.69 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.491 -0.755 . . . . 0.0 109.45 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.464 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 6.7 tpp180 -60.95 118.45 6.73 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.418 -0.801 . . . . 0.0 109.377 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.478 ' HB3' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -82.63 143.53 47.41 Favored Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 121.326 -0.858 . . . . 0.0 109.785 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -55.97 -41.8 73.39 Favored 'Trans proline' 0 C--N 1.321 -0.89 0 C-N-CA 122.649 2.233 . . . . 0.0 111.103 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 mmt -56.39 -24.2 43.07 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.261 -0.899 . . . . 0.0 109.506 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.55 36.97 1.5 Allowed Glycine 0 N--CA 1.497 2.745 0 N-CA-C 109.914 -1.275 . . . . 0.0 109.914 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.478 ' O ' ' HB3' ' A' ' 21' ' ' SER . 15.2 m-20 -134.18 99.22 13.58 Favored Pre-proline 0 N--CA 1.495 1.775 0 O-C-N 121.192 -1.181 . . . . 0.0 110.388 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.545 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.8 Cg_endo -63.54 118.67 5.59 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 C-N-CA 122.039 1.826 . . . . 0.0 110.208 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.483 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.1 m -125.28 128.82 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 CA-C-O 121.868 0.842 . . . . 0.0 110.3 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.6 p -53.39 135.51 39.1 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.296 0.57 . . . . 0.0 109.73 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.6 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 22.9 t-20 -38.33 -47.2 1.19 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.627 -0.67 . . . . 0.0 112.035 -178.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.57 -46.13 27.74 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.223 -0.923 . . . . 0.0 110.858 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 22.6 m -65.48 -42.93 91.66 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.256 -0.903 . . . . 0.0 108.789 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.01 -50.37 66.13 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 110.459 -1.056 . . . . 0.0 110.459 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.463 ' HG ' ' OD1' ' A' ' 29' ' ' ASN . 68.1 mt -59.04 -66.72 0.46 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.369 -1.077 . . . . 0.0 109.608 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.502 ' CZ ' ' HG3' ' A' ' 42' ' ' ARG . 29.8 t80 -43.84 -38.46 3.32 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.558 -0.714 . . . . 0.0 109.687 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.548 ' O ' ' N ' ' A' ' 39' ' ' GLN . 15.9 t80 -62.02 -46.12 90.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.307 -0.87 . . . . 0.0 110.591 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.45 ' HE2' ' HA ' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -60.37 -22.34 63.19 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.219 -1.551 . . . . 0.0 110.251 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.448 HD12 ' O ' ' A' ' 33' ' ' LEU . 7.2 mp -82.11 -55.54 4.5 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.021 -1.049 . . . . 0.0 110.027 -179.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.48 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 34.5 m-70 -97.44 -27.33 14.5 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.249 -0.907 . . . . 0.0 110.49 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 70.35 24.44 4.71 Favored 'General case' 0 N--CA 1.502 2.168 0 CA-C-O 121.591 0.71 . . . . 0.0 111.204 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.6 m -124.83 164.6 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 121.015 -1.053 . . . . 0.0 109.984 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -83.55 151.6 25.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.513 -0.742 . . . . 0.0 109.773 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.502 ' HG3' ' CZ ' ' A' ' 34' ' ' TYR . 13.2 mmt180 -133.84 147.65 65.11 Favored Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.387 -0.82 . . . . 0.0 110.002 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.424 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 1.0 OUTLIER -65.64 150.41 86.42 Favored 'Trans proline' 0 C--N 1.316 -1.145 0 C-N-CA 122.541 2.161 . . . . 0.0 110.656 179.671 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.459 ' O ' ' HB3' ' A' ' 47' ' ' ARG . 1.0 OUTLIER -68.6 0.92 3.57 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.192 -0.942 . . . . 0.0 110.876 179.462 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -35.08 45.46 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.936 -1.102 . . . . 0.0 110.257 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.59 -29.14 41.1 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.11 -0.994 . . . . 0.0 109.724 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 44' ' ' LEU . 0.5 OUTLIER -50.16 142.6 9.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.325 -0.859 . . . . 0.0 110.09 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.48 172.27 7.63 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.469 -0.769 . . . . 0.0 109.859 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -66.53 -66.25 0.58 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.337 -0.852 . . . . 0.0 109.853 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -117.0 164.4 12.41 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.494 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.0 mt -46.49 123.1 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.468 -1.019 . . . . 0.0 110.311 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.49 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -77.18 166.54 23.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.364 -0.835 . . . . 0.0 109.482 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.49 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.67 162.21 40.62 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.335 -0.853 . . . . 0.0 108.985 178.704 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -143.32 -162.06 1.38 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.54 -0.725 . . . . 0.0 109.661 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -62.42 117.14 5.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.98 -1.075 . . . . 0.0 109.089 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.53 134.63 19.27 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.541 -0.725 . . . . 0.0 110.898 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt . . . . . 0 N--CA 1.498 1.973 0 O-C-N 121.64 -0.662 . . . . 0.0 109.976 179.838 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.825 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.3 -15.05 7.75 Favored Glycine 0 N--CA 1.497 2.729 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.487 HG22 ' HB2' ' A' ' 26' ' ' PRO . 5.9 m -66.56 92.6 0.21 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.217 -1.167 . . . . 0.0 109.155 179.475 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 22.3 m -84.66 131.0 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.066 -1.021 . . . . 0.0 108.27 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.54 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 17.3 t -59.02 116.42 3.8 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.288 -0.882 . . . . 0.0 110.765 -178.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.1 m -62.01 -12.46 18.87 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.368 -0.832 . . . . 0.0 110.83 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -106.8 -25.31 11.76 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.946 -1.096 . . . . 0.0 111.516 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.606 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 10.8 p -142.69 18.39 2.0 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.65 -1.281 . . . . 0.0 111.255 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 46.83 21.34 0.14 Allowed 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.405 -0.809 . . . . 0.0 112.555 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.552 HG21 HG23 ' A' ' 15' ' ' THR . 7.5 t -87.14 121.83 30.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.513 -1.367 . . . . 0.0 109.849 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.29 -26.67 21.02 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.461 ' HB ' HG13 ' A' ' 51' ' ' ILE . 6.3 p -89.14 96.22 10.63 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.427 -0.796 . . . . 0.0 108.958 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.552 HG23 HG21 ' A' ' 12' ' ' THR . 5.3 p -118.02 166.41 12.57 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.014 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 69.4 p -96.02 -38.06 10.37 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.686 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 17.0 mt -137.4 90.56 2.52 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.305 -0.872 . . . . 0.0 108.662 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.502 ' CZ2' HG22 ' A' ' 15' ' ' THR . 10.8 m95 -54.12 113.59 1.3 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.118 -0.989 . . . . 0.0 110.433 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.477 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 3.0 tpp180 -99.75 86.18 3.26 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.276 -0.89 . . . . 0.0 109.014 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mmm180 -71.2 90.93 0.92 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.281 -0.887 . . . . 0.0 109.019 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.3 t -55.24 142.65 57.98 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.456 -0.777 . . . . 0.0 110.254 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -56.68 -30.89 85.68 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 C-N-CA 122.682 2.254 . . . . 0.0 110.976 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.28 -22.99 62.02 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.314 -0.866 . . . . 0.0 109.534 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.35 40.74 1.6 Allowed Glycine 0 N--CA 1.496 2.685 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -136.18 105.05 9.47 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.246 -1.15 . . . . 0.0 110.347 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.487 ' HB2' HG22 ' A' ' 5' ' ' THR . 2.3 Cg_endo -64.98 91.96 0.2 Allowed 'Trans proline' 0 C--N 1.314 -1.283 0 C-N-CA 122.337 2.025 . . . . 0.0 109.914 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.54 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.5 m -109.99 125.61 67.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.057 -1.027 . . . . 0.0 110.573 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.479 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.6 p -49.21 133.5 19.06 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.591 -0.693 . . . . 0.0 110.189 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.686 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 4.7 t-20 -39.92 -40.16 0.96 Allowed 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.577 -0.702 . . . . 0.0 111.586 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.54 -43.27 65.08 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.113 -0.992 . . . . 0.0 110.047 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 6.5 m -64.29 -41.52 96.83 Favored 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.55 -36.55 93.36 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 178.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 83.5 mt -73.3 -62.97 1.29 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.545 -0.974 . . . . 0.0 110.168 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 89.2 t80 -51.81 -34.43 40.16 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.128 -0.983 . . . . 0.0 109.141 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.469 ' O ' ' N ' ' A' ' 39' ' ' GLN . 36.0 t80 -58.0 -52.68 64.52 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.428 -0.795 . . . . 0.0 109.22 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 tttp -55.08 -31.33 61.1 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.074 -1.016 . . . . 0.0 110.433 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 2.2 mp -61.29 -68.11 0.34 Allowed 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.215 -0.928 . . . . 0.0 110.576 -179.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.471 ' O ' ' HG3' ' A' ' 39' ' ' GLN . 75.6 m-70 -96.9 10.0 40.32 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.053 -1.03 . . . . 0.0 110.412 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 38' ' ' HIS . 1.9 pt20 45.14 31.32 0.74 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.643 -0.661 . . . . 0.0 111.09 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.461 HG23 ' CB ' ' A' ' 38' ' ' HIS . 3.6 m -127.96 -170.01 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 121.351 -0.843 . . . . 0.0 109.582 179.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -60.62 178.63 0.21 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.274 -0.891 . . . . 0.0 110.558 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.461 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -131.52 106.43 14.42 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.073 -1.017 . . . . 0.0 109.915 -179.031 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -60.08 133.98 53.45 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 C-N-CA 122.387 2.058 . . . . 0.0 111.162 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.606 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -91.01 -1.6 57.79 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.288 -0.882 . . . . 0.0 110.928 -179.83 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 p -58.07 -16.68 13.84 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.067 -1.02 . . . . 0.0 110.903 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 18.0 ttp -94.84 -5.16 45.69 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.885 -1.134 . . . . 0.0 111.036 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.48 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -81.08 168.99 18.01 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 120.549 -1.344 . . . . 0.0 110.335 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -132.85 -174.83 3.58 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.226 -0.921 . . . . 0.0 109.735 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -77.09 -17.91 58.37 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.492 -0.755 . . . . 0.0 110.481 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.48 148.76 19.62 Favored Glycine 0 N--CA 1.5 2.944 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.461 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.0 mt -53.33 110.44 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.311 -1.111 . . . . 0.0 110.091 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -47.03 123.19 5.04 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.831 -0.543 . . . . 0.0 109.955 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.58 156.44 42.43 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.005 -1.06 . . . . 0.0 110.51 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.38 -154.85 0.55 Allowed 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -62.98 87.05 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.045 -1.035 . . . . 0.0 108.615 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 ptt180 -50.81 156.55 0.94 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.397 -0.814 . . . . 0.0 110.715 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? . . . . . 0 N--CA 1.496 1.861 0 O-C-N 121.628 -0.67 . . . . 0.0 109.794 179.638 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.879 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.6 -35.48 4.98 Favored Glycine 0 N--CA 1.498 2.791 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.448 HG22 ' CB ' ' A' ' 26' ' ' PRO . 58.8 m -72.13 93.17 1.4 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.341 -1.093 . . . . 0.0 109.21 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.2 m -86.19 130.16 37.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.51 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 42.6 t -61.31 115.3 3.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.118 -0.988 . . . . 0.0 110.564 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.2 m -62.02 -12.73 20.27 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.416 -0.803 . . . . 0.0 110.864 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.436 ' ND2' HG11 ' A' ' 27' ' ' VAL . 57.2 m-20 -101.59 -30.14 11.55 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.068 -1.02 . . . . 0.0 110.989 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.483 ' SG ' ' CZ ' ' A' ' 47' ' ' ARG . 14.5 p -141.51 26.06 1.98 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.625 -1.297 . . . . 0.0 111.336 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 41.82 20.93 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.613 0 O-C-N 121.307 -0.871 . . . . 0.0 113.163 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.435 ' CG2' ' SG ' ' A' ' 10' ' ' CYS . 7.3 t -85.64 132.96 34.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.411 -1.431 . . . . 0.0 109.945 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.0 t -90.66 -30.41 17.16 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.534 -0.729 . . . . 0.0 109.313 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.5 p -89.98 131.38 35.9 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.332 -0.855 . . . . 0.0 108.861 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.422 ' CG2' ' CB ' ' A' ' 28' ' ' CYS . 19.9 p -148.74 155.8 41.49 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.055 -1.028 . . . . 0.0 110.205 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 27.2 p -75.05 -44.86 45.28 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mt -144.84 114.05 7.0 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.415 ' CZ2' ' O ' ' A' ' 5' ' ' THR . 15.7 m95 -65.97 103.38 0.93 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.308 -0.87 . . . . 0.0 110.273 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.481 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 3.8 tpp180 -81.35 71.36 8.34 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.478 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.43 105.07 0.47 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.287 -0.883 . . . . 0.0 109.464 -179.595 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.406 ' OG ' ' HD2' ' A' ' 22' ' ' PRO . 0.3 OUTLIER -66.88 147.76 99.0 Favored Pre-proline 0 N--CA 1.501 2.113 0 O-C-N 121.295 -0.878 . . . . 0.0 110.193 -179.394 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . 0.406 ' HD2' ' OG ' ' A' ' 21' ' ' SER . 6.2 Cg_exo -54.95 -38.06 93.14 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.586 2.191 . . . . 0.0 111.105 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -23.59 56.32 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.314 -0.867 . . . . 0.0 109.584 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.74 36.98 1.63 Allowed Glycine 0 N--CA 1.497 2.749 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -123.38 101.0 38.09 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.018 -1.283 . . . . 0.0 110.426 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 2.4 Cg_endo -65.05 91.4 0.2 Allowed 'Trans proline' 0 C--N 1.312 -1.364 0 C-N-CA 122.214 1.943 . . . . 0.0 110.096 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.51 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.6 m -109.24 127.48 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.249 -0.907 . . . . 0.0 110.04 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.422 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 9.2 p -51.55 134.1 29.68 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.666 -0.646 . . . . 0.0 109.622 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -39.88 -44.91 1.73 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.546 -0.722 . . . . 0.0 111.545 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.95 -44.17 50.46 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.475 -0.765 . . . . 0.0 110.48 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.6 m -61.59 -46.69 88.77 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.294 -0.879 . . . . 0.0 108.918 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -54.75 -38.59 64.63 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.2 mt -77.73 -60.56 2.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.422 -1.046 . . . . 0.0 109.739 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.627 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 32.9 t80 -49.52 -40.15 36.74 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.331 -0.856 . . . . 0.0 109.443 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.457 ' O ' ' N ' ' A' ' 39' ' ' GLN . 27.2 t80 -56.15 -49.37 74.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.511 -0.743 . . . . 0.0 109.44 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -32.27 69.09 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 120.869 -1.144 . . . . 0.0 110.049 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 4.8 mp -60.37 -67.87 0.35 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.194 -0.941 . . . . 0.0 110.593 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.469 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 56.3 m-70 -95.16 9.83 38.17 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.147 -0.97 . . . . 0.0 110.2 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 8.2 pt20 46.65 29.07 0.88 Allowed 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.655 -0.653 . . . . 0.0 111.29 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.6 m -141.55 165.66 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 121.315 -0.866 . . . . 0.0 109.816 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.79 166.94 15.67 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.194 -0.941 . . . . 0.0 109.581 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.627 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 1.2 mmt180 -147.43 150.29 36.91 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.035 -1.041 . . . . 0.0 109.801 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.48 ' HD2' ' CD ' ' A' ' 42' ' ' ARG . 6.1 Cg_exo -56.54 150.25 52.97 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 C-N-CA 122.341 2.027 . . . . 0.0 110.584 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.472 ' CB ' ' O ' ' A' ' 10' ' ' CYS . 1.2 pp -74.64 1.36 12.38 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.372 -0.83 . . . . 0.0 111.459 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.2 t -59.5 -14.76 14.01 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 120.817 -1.177 . . . . 0.0 110.766 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.3 ttt -72.81 -37.43 67.51 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.918 -1.114 . . . . 0.0 110.489 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.483 ' CZ ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -81.75 169.77 16.53 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.095 -1.003 . . . . 0.0 110.229 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -122.41 -169.9 1.98 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.125 -0.984 . . . . 0.0 110.229 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.72 -82.33 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.582 -0.699 . . . . 0.0 110.92 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -87.37 165.89 35.99 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.9 mt -54.3 136.63 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.003 -1.292 . . . . 0.0 110.109 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -66.36 138.09 57.35 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.677 -0.639 . . . . 0.0 109.825 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.85 163.63 38.97 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.093 -1.004 . . . . 0.0 109.593 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.87 -157.42 0.81 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.507 -0.745 . . . . 0.0 109.294 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -59.67 135.14 57.59 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.968 -1.082 . . . . 0.0 109.487 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.0 tpp180 -55.22 140.56 38.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.596 -0.69 . . . . 0.0 110.216 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.693 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 95.74 -30.14 8.83 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.348 -1.501 . . . . 0.0 109.348 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.483 HG21 ' HB2' ' A' ' 26' ' ' PRO . 11.2 m -58.31 93.46 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.231 -1.158 . . . . 0.0 109.063 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.7 m -85.28 140.16 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.133 -0.979 . . . . 0.0 108.794 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.645 ' HB2' HG23 ' A' ' 12' ' ' THR . 31.4 t -64.67 120.36 12.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.161 -0.962 . . . . 0.0 110.252 -179.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 m -63.23 -14.03 44.63 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.392 -0.817 . . . . 0.0 110.427 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.405 ' ND2' HG11 ' A' ' 27' ' ' VAL . 69.9 m-20 -107.64 -17.18 14.16 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.996 -1.065 . . . . 0.0 111.146 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.499 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 8.4 p -154.01 24.31 0.5 Allowed 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.565 -1.335 . . . . 0.0 111.116 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 7.7 pt20 33.73 34.41 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.605 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 178.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.645 HG23 ' HB2' ' A' ' 7' ' ' CYS . 6.1 t -83.79 131.33 34.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.541 -1.349 . . . . 0.0 109.165 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.3 p -89.28 -1.1 57.94 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.315 -0.865 . . . . 0.0 109.18 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.5 p -128.35 132.25 48.59 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.489 -0.757 . . . . 0.0 109.241 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.537 HG21 ' CZ2' ' A' ' 18' ' ' TRP . 5.7 p -144.9 158.77 43.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.306 -0.871 . . . . 0.0 109.543 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.425 HG22 HG22 ' A' ' 51' ' ' ILE . 48.8 p -85.95 -26.99 25.21 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.641 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 59.9 mt -146.48 94.62 2.47 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.537 ' CZ2' HG21 ' A' ' 15' ' ' THR . 9.7 m95 -57.8 115.6 2.92 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.969 -1.082 . . . . 0.0 110.395 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.27 92.61 4.28 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.314 -0.866 . . . . 0.0 109.289 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -80.47 104.87 11.3 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.0 109.239 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.4 m -64.05 148.11 95.7 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.145 -0.972 . . . . 0.0 110.123 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -55.37 -44.92 44.13 Favored 'Trans proline' 0 C--N 1.319 -1.016 0 C-N-CA 122.771 2.314 . . . . 0.0 111.191 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 41.2 mtt -57.76 -21.54 41.96 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.236 -0.915 . . . . 0.0 110.153 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.429 ' HA2' ' NH1' ' A' ' 20' ' ' ARG . . . 111.04 45.36 0.88 Allowed Glycine 0 N--CA 1.497 2.716 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -128.34 92.68 40.54 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.572 -0.958 . . . . 0.0 110.172 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.484 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.7 Cg_endo -63.47 95.63 0.18 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.08 1.854 . . . . 0.0 109.728 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.532 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.04 124.22 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.099 -1.0 . . . . 0.0 110.617 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.472 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.3 p -49.17 136.15 15.56 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.653 -0.654 . . . . 0.0 109.867 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.641 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 12.2 t-20 -40.2 -41.08 1.23 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.661 -0.65 . . . . 0.0 111.465 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.83 -45.81 59.74 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.372 -0.83 . . . . 0.0 110.265 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 34.6 m -67.92 -39.83 83.47 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.288 -0.882 . . . . 0.0 108.751 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.95 -39.21 95.28 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 65.0 mt -74.72 -60.74 2.14 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.415 -1.05 . . . . 0.0 109.881 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.542 ' CE1' ' HB3' ' A' ' 42' ' ' ARG . 47.3 t80 -49.22 -37.84 24.4 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.378 -0.826 . . . . 0.0 109.106 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.537 ' O ' ' N ' ' A' ' 39' ' ' GLN . 15.9 t80 -62.08 -52.88 62.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.543 -0.723 . . . . 0.0 109.659 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.42 -29.13 14.84 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.651 -1.28 . . . . 0.0 110.434 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.32 -63.39 1.07 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.027 -1.046 . . . . 0.0 110.862 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.454 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 9.7 m-70 -97.42 -32.44 11.85 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.126 -0.984 . . . . 0.0 110.214 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 81.87 26.73 0.18 Allowed 'General case' 0 N--CA 1.504 2.265 0 CA-C-O 121.699 0.761 . . . . 0.0 110.689 -179.853 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.6 m -130.63 168.18 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 O-C-N 120.857 -1.152 . . . . 0.0 109.754 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -73.32 146.82 44.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.21 -0.931 . . . . 0.0 109.18 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.542 ' HB3' ' CE1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -128.5 149.94 73.12 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.069 -1.02 . . . . 0.0 110.456 -179.346 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.402 ' O ' ' HD3' ' A' ' 42' ' ' ARG . 2.1 Cg_endo -62.33 135.67 55.28 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 C-N-CA 122.506 2.137 . . . . 0.0 111.091 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.499 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -84.54 29.54 0.59 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.367 -0.833 . . . . 0.0 111.063 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.0 t -61.21 -17.4 53.03 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.751 -1.218 . . . . 0.0 110.473 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.51 -7.53 57.48 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.899 -1.126 . . . . 0.0 110.608 179.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.453 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -73.34 113.52 10.51 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.61 -1.307 . . . . 0.0 109.251 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.84 -156.25 0.57 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.474 -0.767 . . . . 0.0 110.172 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -73.91 0.12 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.472 -0.768 . . . . 0.0 110.328 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -102.84 174.04 23.11 Favored Glycine 0 N--CA 1.497 2.715 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.425 HG22 HG22 ' A' ' 16' ' ' THR . 6.1 mt -59.02 135.26 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.279 -1.13 . . . . 0.0 110.005 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -69.84 161.6 29.57 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.448 -0.782 . . . . 0.0 110.133 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.51 168.75 26.42 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.38 -0.825 . . . . 0.0 109.048 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.89 -169.37 3.36 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.259 -0.9 . . . . 0.0 109.203 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -56.17 100.13 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.947 -1.096 . . . . 0.0 108.704 179.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -46.43 127.15 8.88 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.572 -0.705 . . . . 0.0 110.7 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt . . . . . 0 N--CA 1.495 1.788 0 O-C-N 121.72 -0.612 . . . . 0.0 110.061 -179.97 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 121.287 0.565 . . . . 0.0 109.974 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.98 0.86 65.69 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.441 HG23 ' CH2' ' A' ' 18' ' ' TRP . 53.5 m -81.46 84.92 6.57 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.862 -1.375 . . . . 0.0 109.976 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.9 m -85.23 114.69 25.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 178.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.657 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 1.7 t -42.61 113.22 0.44 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.45 -0.781 . . . . 0.0 110.932 -178.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' SER . . . . . 0.538 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 53.5 m -65.51 -12.58 54.09 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.134 -0.979 . . . . 0.0 111.276 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.38 -24.84 13.46 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.955 -1.09 . . . . 0.0 110.583 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.495 ' SG ' ' HD3' ' A' ' 47' ' ' ARG . 9.2 p -144.7 25.83 1.44 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.88 -1.137 . . . . 0.0 110.767 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.498 ' HB2' ' CD2' ' A' ' 44' ' ' LEU . 0.0 OUTLIER 38.96 25.6 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.367 -0.833 . . . . 0.0 113.028 178.781 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.532 HG23 ' HB2' ' A' ' 7' ' ' CYS . 5.4 t -89.08 131.2 35.34 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.412 -1.43 . . . . 0.0 109.218 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.2 p -90.03 -29.82 18.15 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.484 ' HB ' ' CG1' ' A' ' 51' ' ' ILE . 2.9 p -93.79 124.8 38.03 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.419 -0.801 . . . . 0.0 109.438 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.454 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 11.9 p -134.01 140.15 46.51 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.35 -0.844 . . . . 0.0 109.244 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 70.4 p -62.14 -36.86 83.07 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 179.076 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.407 HD22 ' HA ' ' A' ' 17' ' ' LEU . 13.2 mt -149.56 112.28 4.79 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.454 ' CZ2' HG23 ' A' ' 15' ' ' THR . 13.8 m95 -59.58 123.44 16.9 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.495 -0.753 . . . . 0.0 110.112 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.473 ' O ' HG23 ' A' ' 27' ' ' VAL . 2.0 ttm180 -116.34 74.47 0.9 Allowed 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.73 119.5 11.31 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.939 -1.101 . . . . 0.0 109.503 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.91 142.62 34.28 Favored Pre-proline 0 N--CA 1.501 2.085 0 O-C-N 121.016 -1.053 . . . . 0.0 110.006 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -56.27 -28.67 72.7 Favored 'Trans proline' 0 C--N 1.32 -0.946 0 C-N-CA 122.722 2.281 . . . . 0.0 110.981 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.5 mtp -55.45 -25.11 34.62 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.469 -0.77 . . . . 0.0 109.63 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.14 35.31 2.55 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.657 -1.377 . . . . 0.0 109.657 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -137.8 108.38 8.4 Favored Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 121.381 -1.07 . . . . 0.0 109.966 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.538 ' HD2' ' OG ' ' A' ' 8' ' ' SER . 2.9 Cg_endo -60.7 99.7 0.15 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 C-N-CA 121.786 1.657 . . . . 0.0 110.087 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.657 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.1 m -109.97 147.51 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.173 -0.954 . . . . 0.0 109.745 179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.448 ' N ' ' SG ' ' A' ' 7' ' ' CYS . 30.4 p -83.5 153.65 24.3 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.286 -0.884 . . . . 0.0 108.656 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.402 ' C ' ' O ' ' A' ' 28' ' ' CYS . 11.2 t-20 -41.36 -42.56 2.27 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.562 -0.712 . . . . 0.0 110.079 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.67 -43.46 97.62 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.32 -0.863 . . . . 0.0 110.794 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 1.7 m -58.97 -44.21 91.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.099 -1.001 . . . . 0.0 108.924 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -68.82 -38.78 85.69 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.496 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 36.3 mt -69.5 -66.07 0.63 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.373 -1.075 . . . . 0.0 110.609 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -49.91 -35.29 23.24 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.98 -1.075 . . . . 0.0 109.57 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.574 ' CE1' ' HG3' ' A' ' 39' ' ' GLN . 29.4 t80 -61.76 -47.7 84.0 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.338 -0.851 . . . . 0.0 109.838 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -57.51 -24.36 55.52 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 120.038 -1.664 . . . . 0.0 110.633 179.528 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.454 HD13 ' O ' ' A' ' 33' ' ' LEU . 2.3 mp -70.78 -67.55 0.5 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.999 -1.063 . . . . 0.0 110.189 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -97.29 -22.12 16.85 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.198 -0.939 . . . . 0.0 110.147 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.574 ' HG3' ' CE1' ' A' ' 35' ' ' TYR . 1.1 tt0 65.27 48.75 2.08 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 121.913 0.863 . . . . 0.0 110.438 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -142.21 169.54 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 O-C-N 121.294 -0.879 . . . . 0.0 109.012 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.4 p-10 -83.92 150.57 25.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.992 -1.067 . . . . 0.0 108.852 179.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.492 ' CG ' ' HD2' ' A' ' 43' ' ' PRO . 64.4 ttt180 -145.08 137.99 13.83 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 120.818 -1.176 . . . . 0.0 110.236 -179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.492 ' HD2' ' CG ' ' A' ' 42' ' ' ARG . 3.3 Cg_exo -59.94 151.18 73.58 Favored 'Trans proline' 0 C--N 1.317 -1.126 0 C-N-CA 122.462 2.108 . . . . 0.0 110.415 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.498 ' CD2' ' HB2' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -83.14 40.52 0.71 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.06 -1.025 . . . . 0.0 111.144 -179.395 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.4 p -70.78 -10.13 58.86 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.913 -1.117 . . . . 0.0 110.309 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.0 ttm -102.3 -19.42 15.02 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.035 -1.041 . . . . 0.0 110.765 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.495 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 1.9 mpt_? -81.64 175.24 10.64 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.856 -1.153 . . . . 0.0 110.171 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.7 166.09 29.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.31 -0.868 . . . . 0.0 109.696 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -58.07 -28.25 64.37 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.309 -0.869 . . . . 0.0 110.342 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -109.17 123.39 6.88 Favored Glycine 0 N--CA 1.497 2.722 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.484 ' CG1' ' HB ' ' A' ' 14' ' ' THR . 5.5 mt -53.37 136.6 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.418 -1.048 . . . . 0.0 110.075 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.81 146.27 40.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.505 -0.747 . . . . 0.0 110.001 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.25 158.82 39.44 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.117 -0.989 . . . . 0.0 109.433 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -151.31 -162.39 1.53 Allowed 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -54.13 103.63 0.09 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.841 -1.162 . . . . 0.0 108.921 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -55.73 160.99 2.32 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.55 -0.719 . . . . 0.0 110.672 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.473 -0.767 . . . . 0.0 110.045 179.758 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.791 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.21 -28.61 13.12 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 108.944 -1.662 . . . . 0.0 108.944 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.473 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 27.8 m -60.13 92.16 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.409 -1.054 . . . . 0.0 109.524 179.302 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 35.3 m -93.33 119.0 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.547 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 9.3 t -46.8 114.93 0.92 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.454 -0.778 . . . . 0.0 110.809 -178.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.4 m -63.13 -14.62 50.76 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.231 -0.918 . . . . 0.0 110.03 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -98.7 -29.16 13.18 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.103 -0.998 . . . . 0.0 110.918 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.584 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 10.4 p -143.16 25.79 1.71 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.649 -1.282 . . . . 0.0 111.456 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.415 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER 37.15 35.54 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.592 -0.693 . . . . 0.0 112.76 178.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.536 ' O ' HG21 ' A' ' 12' ' ' THR . 9.5 t -88.27 138.27 31.59 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.704 -1.248 . . . . 0.0 109.464 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.3 p -101.13 -19.79 15.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.344 -0.848 . . . . 0.0 109.627 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.413 ' HB ' HG13 ' A' ' 51' ' ' ILE . 12.0 p -108.97 113.08 25.65 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.512 -0.743 . . . . 0.0 109.537 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.524 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 4.8 p -132.83 147.41 52.3 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.212 -0.93 . . . . 0.0 110.143 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.456 ' N ' HD11 ' A' ' 51' ' ' ILE . 29.9 p -73.57 -28.06 61.65 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.463 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 18.8 mt -149.81 120.24 7.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.515 -0.741 . . . . 0.0 109.196 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.524 ' CZ2' HG23 ' A' ' 15' ' ' THR . 8.5 m95 -84.68 117.97 24.11 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.427 -0.796 . . . . 0.0 109.796 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.538 ' HD2' ' HA ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -108.7 103.36 12.44 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.156 -0.965 . . . . 0.0 109.14 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 2.0 mmt180 -77.33 119.61 21.21 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.326 -0.859 . . . . 0.0 109.729 -179.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 55.7 m -75.33 149.75 84.57 Favored Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.334 -0.854 . . . . 0.0 110.113 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -53.66 -47.76 25.51 Favored 'Trans proline' 0 C--N 1.321 -0.9 0 C-N-CA 122.793 2.328 . . . . 0.0 111.147 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 7.6 ttt -55.71 -25.55 40.68 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.291 -0.881 . . . . 0.0 109.435 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 114.49 45.62 0.66 Allowed Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -132.11 102.98 14.24 Favored Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.288 -1.125 . . . . 0.0 111.026 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.473 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 2.5 Cg_endo -65.42 105.14 0.7 Allowed 'Trans proline' 0 C--N 1.315 -1.231 0 C-N-CA 122.323 2.015 . . . . 0.0 109.7 178.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.547 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -116.45 126.69 74.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.317 -0.864 . . . . 0.0 110.736 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.434 ' HB3' ' CG2' ' A' ' 12' ' ' THR . 8.1 p -49.92 139.91 12.89 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.648 -0.658 . . . . 0.0 109.787 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.538 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 18.2 t-20 -43.13 -46.71 5.95 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.357 -0.839 . . . . 0.0 112.218 -178.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -46.43 -45.97 18.44 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.346 -0.846 . . . . 0.0 110.615 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 9.9 m -63.23 -44.92 93.9 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.682 -0.636 . . . . 0.0 109.37 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.47 -49.36 77.94 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.2 mt -67.04 -60.6 2.49 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.473 -1.016 . . . . 0.0 109.938 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.477 ' CE2' ' HD3' ' A' ' 42' ' ' ARG . 50.6 t80 -51.41 -43.24 61.93 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.567 -0.708 . . . . 0.0 109.619 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.508 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 47.6 t80 -53.38 -47.33 69.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.411 -0.806 . . . . 0.0 108.866 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -43.09 99.58 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.057 -1.027 . . . . 0.0 110.358 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 9.6 mp -40.86 -56.62 2.17 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 121.506 -0.747 . . . . 0.0 110.705 -179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.442 ' HB2' ' CG2' ' A' ' 40' ' ' VAL . 41.2 m-70 -115.1 6.46 15.17 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.171 -0.956 . . . . 0.0 110.288 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 35' ' ' TYR . 1.7 tm0? 49.36 34.71 6.77 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.397 -0.815 . . . . 0.0 110.13 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.442 ' CG2' ' HB2' ' A' ' 38' ' ' HIS . 3.7 m -141.05 167.14 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 O-C-N 121.121 -0.987 . . . . 0.0 110.17 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -84.53 156.35 21.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.505 -0.747 . . . . 0.0 109.747 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.489 ' CG ' ' HD2' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -151.08 152.07 30.7 Favored Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.296 -0.878 . . . . 0.0 109.545 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.489 ' HD2' ' CG ' ' A' ' 42' ' ' ARG . 4.6 Cg_exo -55.41 143.78 75.63 Favored 'Trans proline' 0 C--N 1.316 -1.174 0 C-N-CA 122.313 2.009 . . . . 0.0 111.147 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.584 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -95.46 37.71 1.18 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.464 -0.773 . . . . 0.0 110.561 -179.582 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -70.57 -6.64 37.97 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.946 -1.096 . . . . 0.0 110.038 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 38.1 mtp -92.15 -16.0 26.89 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.979 -1.075 . . . . 0.0 110.303 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.555 ' HG2' ' HB2' ' A' ' 44' ' ' LEU . 25.3 mmm180 -56.43 151.28 13.49 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.728 -1.232 . . . . 0.0 109.591 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -139.53 155.35 47.57 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.447 -0.783 . . . . 0.0 109.871 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -49.67 -77.59 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.616 -0.678 . . . . 0.0 110.49 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -83.4 148.4 25.16 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.456 HD11 ' N ' ' A' ' 16' ' ' THR . 10.1 mt -54.25 136.89 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.324 -1.104 . . . . 0.0 109.773 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.429 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -75.48 156.0 35.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.552 -0.718 . . . . 0.0 109.836 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.429 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.99 163.01 40.24 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.439 -0.788 . . . . 0.0 109.045 178.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.406 ' HA ' ' HD3' ' A' ' 54' ' ' ARG . 15.6 mmt180 -147.67 -165.81 2.36 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -57.35 111.0 0.95 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.823 -1.173 . . . . 0.0 108.863 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -46.21 128.3 9.48 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.332 -0.855 . . . . 0.0 111.111 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt . . . . . 0 N--CA 1.496 1.851 0 O-C-N 121.637 -0.664 . . . . 0.0 109.322 179.469 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.732 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.91 -37.9 2.08 Favored Glycine 0 N--CA 1.495 2.625 0 N-CA-C 108.909 -1.676 . . . . 0.0 108.909 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.417 ' O ' ' CH2' ' A' ' 18' ' ' TRP . 65.8 m -66.53 89.08 0.14 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.362 -1.081 . . . . 0.0 109.264 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.7 m -85.15 109.72 18.48 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 53.9 t -45.17 113.55 0.59 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.338 -0.851 . . . . 0.0 110.266 -178.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.4 m -63.23 -6.78 4.81 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.366 -0.833 . . . . 0.0 111.285 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -102.9 -31.01 10.47 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.795 -1.19 . . . . 0.0 110.728 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.61 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 17.7 p -138.19 18.84 2.78 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.812 -1.18 . . . . 0.0 111.003 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.82 25.51 0.46 Allowed 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.351 -0.843 . . . . 0.0 111.615 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.464 HG22 ' CB ' ' A' ' 7' ' ' CYS . 5.8 t -88.6 132.53 34.5 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.67 -1.268 . . . . 0.0 109.525 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 p -92.68 -6.66 48.77 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.592 -0.693 . . . . 0.0 109.25 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.0 p -112.69 128.86 56.52 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.33 -0.856 . . . . 0.0 109.686 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.553 HG22 ' CZ2' ' A' ' 18' ' ' TRP . 5.4 p -149.07 152.56 36.42 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.059 -1.025 . . . . 0.0 109.883 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 19.5 p -83.65 -31.06 26.38 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.6 -0.687 . . . . 0.0 109.461 179.501 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.631 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 24.9 mt -141.48 87.4 2.07 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.392 -0.818 . . . . 0.0 108.873 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.553 ' CZ2' HG22 ' A' ' 15' ' ' THR . 11.5 m95 -53.32 103.14 0.07 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.247 -0.908 . . . . 0.0 110.357 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.495 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 2.3 tpt180 -88.61 83.94 6.75 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.35 -0.844 . . . . 0.0 109.259 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.8 tpp180 -71.44 114.64 9.72 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.299 -0.876 . . . . 0.0 108.903 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 26.4 p -84.01 139.6 39.85 Favored Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.178 -0.951 . . . . 0.0 109.573 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -55.86 -31.79 82.51 Favored 'Trans proline' 0 C--N 1.319 -1.011 0 C-N-CA 122.589 2.193 . . . . 0.0 111.053 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -23.81 44.88 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.436 -0.79 . . . . 0.0 109.343 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.11 28.19 3.95 Favored Glycine 0 N--CA 1.496 2.664 0 N-CA-C 109.994 -1.242 . . . . 0.0 109.994 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -129.47 99.79 20.65 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.052 -1.263 . . . . 0.0 110.14 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.457 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 Cg_endo -66.09 108.04 1.25 Allowed 'Trans proline' 0 C--N 1.314 -1.278 0 C-N-CA 122.216 1.944 . . . . 0.0 109.818 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.529 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.8 m -121.12 125.9 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.109 -0.994 . . . . 0.0 110.351 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.509 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.9 p -51.4 131.84 29.04 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.56 -0.713 . . . . 0.0 109.514 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.631 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 6.0 t-20 -41.97 -40.37 2.17 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.486 -0.759 . . . . 0.0 111.725 -178.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.35 -38.43 53.14 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.113 -0.992 . . . . 0.0 109.79 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.56 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 2.3 m -68.06 -42.22 80.8 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.65 -57.04 17.92 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 30.4 mt -59.71 -42.88 94.06 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.512 -0.993 . . . . 0.0 109.006 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -57.95 -42.58 85.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.353 -0.842 . . . . 0.0 109.268 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.558 ' HB2' ' NE ' ' A' ' 42' ' ' ARG . 41.4 t80 -55.79 -36.3 67.24 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.305 -0.872 . . . . 0.0 110.169 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -79.29 -49.93 11.69 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.75 -1.219 . . . . 0.0 110.092 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -49.34 -33.01 12.4 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.326 -0.859 . . . . 0.0 110.219 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -118.3 -6.18 10.82 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.137 -0.977 . . . . 0.0 110.64 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.47 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.4 OUTLIER 50.07 34.88 8.9 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.096 -1.002 . . . . 0.0 109.937 -179.295 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.417 ' O ' ' CD2' ' A' ' 35' ' ' TYR . 3.4 m -138.71 -169.11 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 O-C-N 121.271 -0.893 . . . . 0.0 109.383 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -176.02 0.05 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.27 -0.894 . . . . 0.0 109.771 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.56 ' HG2' ' O ' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -135.63 86.26 28.87 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.011 -1.056 . . . . 0.0 110.047 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -64.79 147.26 89.52 Favored 'Trans proline' 0 C--N 1.314 -1.279 0 C-N-CA 122.367 2.045 . . . . 0.0 110.46 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.61 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -91.34 12.78 19.32 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.093 -1.004 . . . . 0.0 110.523 179.661 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 p -53.96 -26.12 24.14 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 120.955 -1.091 . . . . 0.0 110.611 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 8.1 ttp -94.61 -6.65 43.0 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.197 -0.939 . . . . 0.0 110.845 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.457 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -81.47 162.4 23.29 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.931 -1.105 . . . . 0.0 110.395 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.518 ' HD2' ' HG3' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -146.18 -173.56 4.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.525 -0.734 . . . . 0.0 109.118 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.71 -9.05 58.18 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.383 -0.823 . . . . 0.0 111.598 -179.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -141.53 149.74 21.34 Favored Glycine 0 N--CA 1.501 3.026 0 O-C-N 120.53 -1.356 . . . . 0.0 110.727 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.7 mt -63.6 131.76 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.379 -1.071 . . . . 0.0 109.567 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.518 ' HG3' ' HD2' ' A' ' 48' ' ' LYS . 3.6 mt-30 -63.73 136.85 57.77 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.335 -0.853 . . . . 0.0 110.145 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.61 160.67 40.63 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.102 -0.999 . . . . 0.0 109.853 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.51 -155.67 0.63 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -56.39 114.96 2.22 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.835 -1.165 . . . . 0.0 108.503 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -51.78 143.13 13.59 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.508 -0.745 . . . . 0.0 110.773 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt . . . . . 0 N--CA 1.494 1.764 0 O-C-N 121.503 -0.748 . . . . 0.0 109.529 179.558 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.817 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.27 -31.93 8.16 Favored Glycine 0 N--CA 1.495 2.584 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.496 HG21 ' CB ' ' A' ' 26' ' ' PRO . 55.1 m -66.59 93.97 0.27 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.284 -1.127 . . . . 0.0 109.917 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.6 m -100.14 138.73 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 12.2 t -58.18 118.79 5.85 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.256 -0.902 . . . . 0.0 110.478 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.2 m -64.11 -12.75 42.36 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.245 -0.909 . . . . 0.0 110.153 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -105.04 -25.46 12.53 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.183 -0.948 . . . . 0.0 110.855 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.552 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 7.5 p -147.9 28.05 0.95 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.657 -1.277 . . . . 0.0 111.12 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 30.69 40.56 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.688 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 178.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.609 ' HB ' ' HD3' ' A' ' 47' ' ' ARG . 12.2 t -90.44 139.7 30.43 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.976 -1.077 . . . . 0.0 108.96 178.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -99.0 -24.97 14.72 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.946 -1.096 . . . . 0.0 109.493 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.8 p -101.25 116.06 31.93 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.494 -0.754 . . . . 0.0 109.232 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.516 HG21 HG22 ' A' ' 12' ' ' THR . 6.2 p -138.49 154.93 48.82 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.028 -1.045 . . . . 0.0 110.037 -179.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 40.9 p -74.87 -31.33 61.59 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.149 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.412 HD21 ' HA ' ' A' ' 17' ' ' LEU . 8.8 mt -153.94 125.01 7.32 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -82.04 106.51 14.01 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.628 -0.67 . . . . 0.0 109.979 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.537 ' HB2' ' O ' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -80.91 77.45 7.79 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.071 -1.018 . . . . 0.0 108.985 179.43 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.457 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 18.3 tpt180 -61.29 99.62 0.11 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.546 ' HB3' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -60.21 152.03 64.61 Favored Pre-proline 0 N--CA 1.5 2.026 0 O-C-N 121.395 -0.816 . . . . 0.0 109.545 -179.421 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -54.17 -44.21 51.4 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 C-N-CA 122.645 2.23 . . . . 0.0 110.809 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -19.08 64.95 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.255 -0.903 . . . . 0.0 109.731 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.02 41.63 1.16 Allowed Glycine 0 N--CA 1.496 2.678 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.546 ' HB2' ' HB3' ' A' ' 21' ' ' SER . 51.1 m-20 -120.02 96.25 49.32 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.274 -1.133 . . . . 0.0 110.196 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.496 ' CB ' HG21 ' A' ' 5' ' ' THR . 1.3 Cg_endo -68.22 96.44 0.47 Allowed 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.155 1.904 . . . . 0.0 109.838 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.537 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 2.0 m -111.45 122.71 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.064 -1.022 . . . . 0.0 110.549 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.408 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 4.2 p -45.51 129.87 8.63 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.5 -0.75 . . . . 0.0 110.125 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -32.35 -51.37 0.26 Allowed 'General case' 0 N--CA 1.507 2.424 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.54 -47.85 27.84 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.313 -0.867 . . . . 0.0 111.128 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 14.8 m -60.05 -45.79 91.67 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.381 -0.824 . . . . 0.0 108.87 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.85 -50.17 70.59 Favored Glycine 0 N--CA 1.493 2.463 0 N-CA-C 110.229 -1.148 . . . . 0.0 110.229 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.7 mt -63.9 -62.11 1.85 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.369 -1.077 . . . . 0.0 110.359 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.554 ' CD1' ' HB2' ' A' ' 42' ' ' ARG . 21.0 t80 -51.67 -44.15 62.96 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.317 -0.864 . . . . 0.0 109.177 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.475 ' O ' ' N ' ' A' ' 39' ' ' GLN . 23.4 t80 -50.81 -48.48 59.72 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.573 -0.705 . . . . 0.0 109.41 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.22 -37.98 88.98 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.043 -1.035 . . . . 0.0 110.657 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.5 mp -46.19 -53.97 9.56 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.05 -1.031 . . . . 0.0 110.008 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.489 ' HB2' HG23 ' A' ' 40' ' ' VAL . 88.1 m-70 -112.05 10.15 20.38 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.268 -0.895 . . . . 0.0 109.73 179.045 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.475 ' N ' ' O ' ' A' ' 35' ' ' TYR . 2.5 tt0 47.62 35.12 4.1 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.4 -0.813 . . . . 0.0 110.136 -178.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.489 HG23 ' HB2' ' A' ' 38' ' ' HIS . 3.7 m -132.94 -177.9 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 O-C-N 121.517 -0.74 . . . . 0.0 109.385 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -75.59 179.47 5.32 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.278 -0.889 . . . . 0.0 110.661 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.554 ' HB2' ' CD1' ' A' ' 34' ' ' TYR . 10.0 ttp180 -150.19 132.62 8.08 Favored Pre-proline 0 N--CA 1.498 1.957 0 O-C-N 121.198 -0.939 . . . . 0.0 109.787 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.407 ' HD2' ' HG2' ' A' ' 42' ' ' ARG . 1.2 Cg_endo -63.79 149.36 90.92 Favored 'Trans proline' 0 C--N 1.316 -1.154 0 C-N-CA 122.155 1.904 . . . . 0.0 110.657 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.552 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 1.1 pp -85.98 -1.47 57.36 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.02 -1.05 . . . . 0.0 110.245 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 t -61.3 -11.39 9.61 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.119 -0.988 . . . . 0.0 110.856 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.19 -7.36 48.54 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.782 -1.198 . . . . 0.0 110.694 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.609 ' HD3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -74.18 172.92 10.89 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.556 -1.34 . . . . 0.0 110.253 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.411 ' HG3' ' N ' ' A' ' 49' ' ' ASP . 1.9 tppp? -136.61 163.98 29.29 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.25 -0.906 . . . . 0.0 109.3 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . 0.411 ' N ' ' HG3' ' A' ' 48' ' ' LYS . 6.4 t70 -49.09 -80.46 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.478 -0.764 . . . . 0.0 110.351 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.85 161.96 26.1 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.445 HG22 HD11 ' A' ' 51' ' ' ILE . 5.4 mt -57.06 126.58 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.291 -1.123 . . . . 0.0 109.737 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.15 154.23 42.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.498 -0.751 . . . . 0.0 109.58 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.19 162.41 40.19 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.166 -0.959 . . . . 0.0 109.515 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.6 mmm180 -150.88 -172.61 4.25 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.54 -0.725 . . . . 0.0 110.421 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.19 79.53 0.97 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.13 -0.981 . . . . 0.0 109.562 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.58 162.2 4.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.604 -0.685 . . . . 0.0 110.41 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.8 pttt . . . . . 0 N--CA 1.498 1.971 0 O-C-N 121.442 -0.786 . . . . 0.0 109.919 179.353 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.798 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.38 -26.67 4.1 Favored Glycine 0 N--CA 1.495 2.624 0 N-CA-C 109.275 -1.53 . . . . 0.0 109.275 -179.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.518 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 98.5 m -59.46 91.7 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.277 -1.131 . . . . 0.0 109.349 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.0 m -83.91 111.0 19.26 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.049 -1.032 . . . . 0.0 108.261 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.494 ' CB ' HG23 ' A' ' 12' ' ' THR . 40.8 t -48.24 109.5 0.24 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.438 -0.789 . . . . 0.0 110.158 -178.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.6 m -58.29 -12.15 3.42 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.43 -0.794 . . . . 0.0 111.368 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.451 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.9 OUTLIER -96.16 -30.67 13.38 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.965 -1.084 . . . . 0.0 110.793 -179.68 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.577 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 17.4 p -141.03 19.3 2.28 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.661 -1.274 . . . . 0.0 111.41 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.435 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.9 OUTLIER 47.5 25.61 0.66 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.321 -0.862 . . . . 0.0 111.768 179.199 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.494 HG23 ' CB ' ' A' ' 7' ' ' CYS . 8.1 t -87.49 132.96 33.84 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.81 -1.181 . . . . 0.0 109.816 179.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 94.8 p -90.24 -23.15 21.32 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.3 p -98.99 130.91 45.36 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.542 HG22 ' CZ3' ' A' ' 18' ' ' TRP . 12.9 p -148.82 138.44 21.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.271 -0.893 . . . . 0.0 109.646 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.568 HG22 ' CG2' ' A' ' 51' ' ' ILE . 2.5 p -64.15 -34.87 79.05 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.582 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 46.7 mt -144.48 104.78 4.1 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 121.401 0.62 . . . . 0.0 109.5 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.542 ' CZ3' HG22 ' A' ' 15' ' ' THR . 6.5 m95 -62.56 99.93 0.17 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.191 -0.943 . . . . 0.0 109.85 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.471 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -83.94 82.08 8.5 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.395 -0.815 . . . . 0.0 108.954 179.568 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.45 ' NH1' ' HG3' ' A' ' 26' ' ' PRO . 4.1 tpp180 -63.06 96.14 0.09 Allowed 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -58.81 133.6 86.64 Favored Pre-proline 0 N--CA 1.495 1.798 0 O-C-N 121.385 -0.822 . . . . 0.0 110.289 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -56.4 -33.08 91.0 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 C-N-CA 122.517 2.145 . . . . 0.0 110.556 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -23.91 31.58 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.386 -0.821 . . . . 0.0 109.767 178.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.49 26.95 3.24 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -132.63 112.39 13.86 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 120.959 -1.318 . . . . 0.0 110.408 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.518 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 1.1 Cg_endo -67.95 105.95 1.24 Allowed 'Trans proline' 0 C--N 1.313 -1.321 0 C-N-CA 122.09 1.86 . . . . 0.0 109.474 178.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.478 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.1 m -121.56 127.27 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.086 -1.009 . . . . 0.0 110.246 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.483 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.4 p -48.98 132.28 18.71 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.457 -0.777 . . . . 0.0 109.09 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.582 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.8 t-20 -35.7 -48.09 0.52 Allowed 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.685 -0.634 . . . . 0.0 111.761 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -45.42 -51.67 11.1 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.346 -0.847 . . . . 0.0 110.9 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 32.8 m -61.28 -47.99 83.44 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.395 -0.816 . . . . 0.0 109.243 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.07 -33.56 75.06 Favored Glycine 0 N--CA 1.497 2.75 0 N-CA-C 110.841 -0.903 . . . . 0.0 110.841 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 68.0 mt -74.16 -62.45 1.51 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.252 -1.146 . . . . 0.0 110.19 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.499 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 25.0 t80 -55.52 -40.66 72.07 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.102 -0.999 . . . . 0.0 108.917 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.467 ' O ' ' N ' ' A' ' 39' ' ' GLN . 40.9 t80 -54.89 -46.13 74.77 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 0.0 109.675 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -61.36 -32.85 72.76 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.761 -1.212 . . . . 0.0 110.3 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -57.95 -62.13 2.03 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.214 -0.928 . . . . 0.0 110.863 -179.338 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.502 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 47.0 m-70 -105.0 9.8 34.34 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.011 -1.056 . . . . 0.0 110.364 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.3 OUTLIER 50.05 27.47 2.51 Favored 'General case' 0 N--CA 1.505 2.303 0 CA-C-O 121.589 0.709 . . . . 0.0 110.685 -179.117 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.408 HG23 ' CB ' ' A' ' 38' ' ' HIS . 6.2 m -130.94 160.95 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 O-C-N 121.237 -0.914 . . . . 0.0 110.19 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -79.87 162.49 24.99 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.371 0.605 . . . . 0.0 110.101 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.499 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -145.98 150.49 42.51 Favored Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.298 -0.876 . . . . 0.0 109.954 179.509 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -59.11 146.77 93.27 Favored 'Trans proline' 0 C--N 1.315 -1.213 0 C-N-CA 122.534 2.156 . . . . 0.0 111.031 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.577 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -83.93 37.21 0.59 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.297 -0.877 . . . . 0.0 110.865 -179.866 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.0 p -68.14 -8.38 38.02 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.007 -1.058 . . . . 0.0 110.293 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.3 mmm -93.0 -20.26 20.76 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.11 -0.994 . . . . 0.0 110.304 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.525 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -66.77 142.68 57.29 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.88 -1.137 . . . . 0.0 109.614 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -131.59 -155.42 0.69 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.35 -0.844 . . . . 0.0 109.53 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.15 -84.85 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.453 -0.779 . . . . 0.0 110.644 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -110.52 170.45 14.02 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.281 -1.527 . . . . 0.0 109.281 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.568 ' CG2' HG22 ' A' ' 16' ' ' THR . 5.3 mt -52.6 130.15 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.259 -1.142 . . . . 0.0 110.256 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.48 165.69 24.78 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.496 0.665 . . . . 0.0 109.545 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.88 166.52 29.29 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.292 -0.88 . . . . 0.0 109.287 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.67 -168.05 3.0 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.509 -0.744 . . . . 0.0 109.749 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.72 113.02 11.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.103 -0.998 . . . . 0.0 108.835 179.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.437 ' HG3' ' N ' ' A' ' 57' ' ' LYS . 2.7 ttp180 -51.43 151.69 2.94 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.451 -0.781 . . . . 0.0 109.964 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . 0.437 ' N ' ' HG3' ' A' ' 56' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.798 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 101.07 -46.66 1.28 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 108.635 -1.786 . . . . 0.0 108.635 -178.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.451 HG21 ' CB ' ' A' ' 26' ' ' PRO . 53.1 m -83.13 93.38 7.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.137 -1.213 . . . . 0.0 108.844 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.6 m -98.21 121.13 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 46.5 t -50.22 113.56 0.9 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.374 -0.829 . . . . 0.0 110.151 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.6 m -62.95 -11.84 21.44 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.139 -0.976 . . . . 0.0 111.112 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -95.53 -31.68 13.21 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.911 -1.118 . . . . 0.0 110.747 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.434 ' SG ' ' CG2' ' A' ' 12' ' ' THR . 16.4 p -139.5 18.33 2.55 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.781 -1.199 . . . . 0.0 110.946 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 48.18 24.93 0.73 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.269 -0.894 . . . . 0.0 112.246 178.815 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.49 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 14.6 t -87.35 135.18 33.42 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.602 -1.312 . . . . 0.0 110.061 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.4 p -90.13 -16.14 30.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.487 -0.758 . . . . 0.0 109.145 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 44.9 p -102.92 129.56 49.68 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.289 -0.882 . . . . 0.0 108.713 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.487 HG22 ' CZ2' ' A' ' 18' ' ' TRP . 7.0 p -146.36 148.76 32.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.204 -0.935 . . . . 0.0 110.092 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.8 p -72.03 -37.25 69.78 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 179.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 mt -147.07 105.55 3.8 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.487 ' CZ2' HG22 ' A' ' 15' ' ' THR . 11.4 m95 -59.51 98.62 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.466 -0.771 . . . . 0.0 110.306 -179.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.67 75.91 3.34 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.326 -0.859 . . . . 0.0 108.784 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.433 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.08 94.75 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.4 139.97 96.52 Favored Pre-proline 0 N--CA 1.499 1.992 0 O-C-N 121.44 -0.788 . . . . 0.0 110.429 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -53.98 -39.15 86.18 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 C-N-CA 122.832 2.355 . . . . 0.0 111.184 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -22.43 48.44 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.273 -0.892 . . . . 0.0 109.69 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.77 32.81 2.57 Favored Glycine 0 N--CA 1.498 2.77 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -128.04 98.13 27.79 Favored Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.167 -1.196 . . . . 0.0 110.076 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.504 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.1 Cg_endo -65.08 112.88 2.18 Favored 'Trans proline' 0 C--N 1.312 -1.381 0 C-N-CA 122.26 1.973 . . . . 0.0 110.191 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.435 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -124.28 131.2 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.151 -0.968 . . . . 0.0 109.953 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.479 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 6.1 p -53.67 134.73 41.62 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.43 0.633 . . . . 0.0 109.763 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -36.87 -44.73 0.51 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.724 -0.61 . . . . 0.0 112.075 -178.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.79 -47.81 59.64 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.331 -0.855 . . . . 0.0 110.187 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.9 m -68.36 -39.51 81.79 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.143 -0.973 . . . . 0.0 109.116 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.07 -36.91 69.25 Favored Glycine 0 N--CA 1.497 2.751 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 61.8 mt -80.17 -58.29 3.22 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.312 -1.11 . . . . 0.0 110.107 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.552 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 23.6 t80 -51.61 -36.69 46.75 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 39' ' ' GLN . 17.9 t80 -59.79 -51.7 68.61 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.312 -0.867 . . . . 0.0 109.56 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -52.75 -26.15 13.3 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.664 -1.273 . . . . 0.0 110.353 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.4 mp -72.45 -66.33 0.67 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.961 -1.087 . . . . 0.0 110.381 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.462 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 77.5 m-70 -94.6 -26.57 16.31 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.992 -1.067 . . . . 0.0 110.797 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 75.56 25.53 1.21 Allowed 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 121.588 0.709 . . . . 0.0 111.374 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -124.63 167.02 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 120.941 -1.099 . . . . 0.0 110.431 179.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.6 p-10 -85.66 131.13 34.4 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.333 -0.854 . . . . 0.0 109.417 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.552 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 25.3 mmt180 -109.16 149.13 39.29 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.088 -1.008 . . . . 0.0 110.325 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.07 150.9 84.78 Favored 'Trans proline' 0 C--N 1.314 -1.263 0 C-N-CA 122.372 2.048 . . . . 0.0 110.431 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.596 ' HB2' ' HD3' ' A' ' 47' ' ' ARG . 0.7 OUTLIER -74.33 29.83 0.08 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.187 -0.946 . . . . 0.0 111.231 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.7 p -67.97 -17.97 64.59 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.458 -1.401 . . . . 0.0 109.483 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.52 2.73 52.71 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.392 -0.818 . . . . 0.0 109.929 179.28 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.596 ' HD3' ' HB2' ' A' ' 44' ' ' LEU . 3.0 ttp180 -67.39 173.11 4.24 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.897 -1.127 . . . . 0.0 109.51 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.76 164.85 37.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.165 -0.96 . . . . 0.0 109.773 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -44.43 -70.25 0.11 Allowed 'General case' 0 N--CA 1.504 2.236 0 CA-C-O 121.419 0.628 . . . . 0.0 109.626 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -121.38 175.16 16.12 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 108.632 -1.787 . . . . 0.0 108.632 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.8 mt -51.39 124.73 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.277 -1.131 . . . . 0.0 109.706 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.27 160.63 31.84 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.306 -0.871 . . . . 0.0 108.654 179.238 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.95 165.54 36.16 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.085 -1.01 . . . . 0.0 108.996 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -143.55 -178.33 5.84 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.213 -0.929 . . . . 0.0 109.523 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -52.15 123.67 11.18 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.31 -0.869 . . . . 0.0 108.722 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -48.41 113.48 0.76 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.61 -0.682 . . . . 0.0 109.43 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.2 ttpt . . . . . 0 N--CA 1.496 1.871 0 O-C-N 121.572 -0.705 . . . . 0.0 109.201 -179.622 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 115.23 -24.35 10.67 Favored Glycine 0 N--CA 1.496 2.687 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 -179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.467 HG22 ' HB2' ' A' ' 26' ' ' PRO . 30.7 m -71.96 92.38 1.27 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.873 -1.369 . . . . 0.0 109.309 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.6 m -93.54 117.03 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.5 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 44.7 t -45.51 112.37 0.45 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.446 -0.784 . . . . 0.0 110.409 -178.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 39.4 m -62.5 -8.94 7.09 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.429 -0.795 . . . . 0.0 111.305 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.41 ' HB2' HG11 ' A' ' 27' ' ' VAL . 1.8 m-80 -104.96 -26.69 12.07 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.797 -1.189 . . . . 0.0 111.199 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.574 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 13.1 p -139.67 17.14 2.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.693 -1.254 . . . . 0.0 111.334 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 49.55 22.13 0.71 Allowed 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.237 -0.914 . . . . 0.0 111.995 178.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.545 ' HB ' ' SG ' ' A' ' 10' ' ' CYS . 2.0 t -90.04 125.48 35.42 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.799 -1.188 . . . . 0.0 109.473 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.4 p -88.95 -21.66 23.46 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.377 -0.827 . . . . 0.0 109.38 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.4 p -89.52 117.21 28.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.359 -0.838 . . . . 0.0 109.001 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.545 HG21 ' CH2' ' A' ' 18' ' ' TRP . 6.3 p -144.86 147.51 32.9 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.923 -1.111 . . . . 0.0 110.475 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 77.0 p -80.05 -30.37 39.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.541 -0.724 . . . . 0.0 109.08 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.617 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -144.45 112.02 6.12 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.184 -0.947 . . . . 0.0 109.312 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.545 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.5 m95 -74.67 90.9 2.32 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.107 -0.995 . . . . 0.0 109.749 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.15 83.08 3.64 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.384 -0.822 . . . . 0.0 109.377 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.446 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.6 mmt180 -66.41 110.05 2.96 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.151 -0.968 . . . . 0.0 109.348 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 83.1 p -71.03 149.24 94.74 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.212 -0.93 . . . . 0.0 109.465 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -56.11 -22.34 39.24 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 122.432 2.088 . . . . 0.0 111.229 -179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -75.23 -3.43 33.12 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.196 -0.94 . . . . 0.0 110.169 179.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.9 34.41 9.0 Favored Glycine 0 N--CA 1.495 2.597 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -127.47 101.4 24.53 Favored Pre-proline 0 N--CA 1.494 1.741 0 O-C-N 121.458 -1.025 . . . . 0.0 110.43 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.492 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.3 Cg_endo -65.37 105.02 0.68 Allowed 'Trans proline' 0 C--N 1.315 -1.22 0 C-N-CA 122.593 2.195 . . . . 0.0 110.099 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.5 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.74 124.98 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.131 -0.981 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.489 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.0 p -49.19 131.2 19.7 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.459 0.647 . . . . 0.0 110.074 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.617 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 23.5 t-20 -37.18 -48.84 0.87 Allowed 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.629 -0.669 . . . . 0.0 111.548 -178.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -45.04 -44.08 9.86 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.425 -0.797 . . . . 0.0 110.296 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.505 ' HB3' ' HD3' ' A' ' 42' ' ' ARG . 3.4 m -64.03 -44.79 91.46 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.29 -33.24 85.46 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.49 ' O ' HD12 ' A' ' 37' ' ' LEU . 41.6 mt -76.33 -60.45 2.33 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.471 -1.017 . . . . 0.0 109.617 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.54 ' CE1' ' HD2' ' A' ' 43' ' ' PRO . 51.3 t80 -48.05 -38.88 18.39 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.303 -0.873 . . . . 0.0 109.289 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.495 ' CD2' ' O ' ' A' ' 40' ' ' VAL . 58.3 t80 -54.24 -53.9 47.37 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.439 -0.788 . . . . 0.0 109.602 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.04 -38.11 89.89 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.113 -0.992 . . . . 0.0 110.459 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.49 HD12 ' O ' ' A' ' 33' ' ' LEU . 4.1 mp -42.77 -57.5 2.74 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.437 -0.79 . . . . 0.0 110.353 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.572 ' HB2' HG22 ' A' ' 40' ' ' VAL . 33.0 m-70 -118.3 13.69 13.7 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.286 -0.884 . . . . 0.0 109.705 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.47 ' N ' ' O ' ' A' ' 35' ' ' TYR . 17.6 tt0 45.76 47.33 11.9 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 121.842 0.83 . . . . 0.0 109.788 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.572 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.1 m -130.86 -170.82 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 121.545 -0.722 . . . . 0.0 109.71 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -61.69 -173.62 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.267 -0.896 . . . . 0.0 110.177 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.505 ' HD3' ' HB3' ' A' ' 31' ' ' CYS . 29.7 mtt180 -130.0 93.55 33.5 Favored Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 121.1 -1.0 . . . . 0.0 109.976 -179.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.54 ' HD2' ' CE1' ' A' ' 34' ' ' TYR . 5.0 Cg_exo -58.75 126.63 21.78 Favored 'Trans proline' 0 C--N 1.318 -1.061 0 C-N-CA 122.559 2.173 . . . . 0.0 110.866 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.574 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -96.88 17.32 17.03 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.45 -0.781 . . . . 0.0 110.586 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.2 p -74.16 -4.57 36.6 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.996 -1.065 . . . . 0.0 110.198 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -103.91 -0.66 28.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.082 -1.011 . . . . 0.0 110.626 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 9.4 mmm180 -51.13 141.36 14.44 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.628 -1.295 . . . . 0.0 110.215 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmm -119.38 -163.99 1.02 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.514 -0.741 . . . . 0.0 109.52 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -79.51 -89.35 0.06 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.209 -0.932 . . . . 0.0 110.175 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -96.11 165.91 24.34 Favored Glycine 0 N--CA 1.499 2.864 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.4 mt -54.3 129.06 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.246 -1.15 . . . . 0.0 109.767 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -70.33 141.91 52.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.297 -0.877 . . . . 0.0 109.275 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.72 158.13 40.54 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.946 -1.097 . . . . 0.0 110.159 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.459 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 1.1 mtm-85 -153.16 -158.47 0.89 Allowed 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -58.37 106.11 0.35 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.04 139.29 4.54 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.521 0.677 . . . . 0.0 110.94 -178.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 O-C-N 121.581 -0.699 . . . . 0.0 109.949 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.88 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 94.35 -37.13 3.49 Favored Glycine 0 N--CA 1.497 2.759 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.4 m -60.61 96.37 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.273 -1.134 . . . . 0.0 109.231 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.8 m -96.94 138.72 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 22.1 t -59.88 122.67 14.82 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.425 -0.797 . . . . 0.0 110.835 -178.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -65.45 -16.04 63.24 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.193 -0.942 . . . . 0.0 109.965 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -104.11 -19.17 14.26 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.031 -1.043 . . . . 0.0 111.209 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.513 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 9.0 p -154.0 26.28 0.48 Allowed 'General case' 0 N--CA 1.502 2.154 0 O-C-N 120.63 -1.294 . . . . 0.0 111.151 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 1.0 OUTLIER 31.15 37.11 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.642 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 178.901 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.59 HG21 HG21 ' A' ' 15' ' ' THR . 5.5 t -90.39 131.85 35.93 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.565 -1.335 . . . . 0.0 108.794 178.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 91.6 p -89.39 -26.37 21.06 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.447 -0.783 . . . . 0.0 109.426 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.5 p -99.51 113.3 25.6 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.485 -0.76 . . . . 0.0 109.124 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.59 HG21 HG21 ' A' ' 12' ' ' THR . 6.8 p -132.96 164.29 27.29 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.31 -0.869 . . . . 0.0 110.197 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.5 p -74.85 -45.95 39.67 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.517 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.405 ' HA ' HD22 ' A' ' 17' ' ' LEU . 12.8 mt -147.57 116.49 6.8 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -64.96 98.92 0.31 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.475 -0.765 . . . . 0.0 110.112 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.88 75.38 6.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.514 -0.741 . . . . 0.0 109.62 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.425 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.9 tpp180 -64.2 95.59 0.13 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.277 -0.889 . . . . 0.0 108.976 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.14 147.13 47.38 Favored Pre-proline 0 N--CA 1.499 2.017 0 O-C-N 121.437 -0.789 . . . . 0.0 110.133 -179.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -56.16 -33.66 91.01 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.383 2.055 . . . . 0.0 110.696 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.8 mtm -60.32 -23.15 63.98 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.214 -0.929 . . . . 0.0 109.537 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.89 45.64 1.01 Allowed Glycine 0 N--CA 1.497 2.733 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -134.84 104.26 10.77 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.468 -1.019 . . . . 0.0 110.277 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.49 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 Cg_endo -66.13 87.59 0.25 Allowed 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 122.317 2.011 . . . . 0.0 109.639 178.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.534 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -109.53 124.48 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.111 -0.993 . . . . 0.0 110.371 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.538 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.5 p -46.25 134.28 8.82 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.744 -0.597 . . . . 0.0 109.591 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.424 ' OD1' HD12 ' A' ' 33' ' ' LEU . 2.2 t-20 -34.74 -46.29 0.29 Allowed 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.747 -0.595 . . . . 0.0 111.46 -179.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.66 -51.81 20.33 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.509 -0.745 . . . . 0.0 111.27 -179.831 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.512 ' HA ' ' HD3' ' A' ' 42' ' ' ARG . 52.0 m -62.35 -40.86 97.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.148 -0.97 . . . . 0.0 109.885 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.11 -35.69 91.86 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.424 HD12 ' OD1' ' A' ' 29' ' ' ASN . 83.6 mt -73.69 -62.19 1.58 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.294 -1.121 . . . . 0.0 109.717 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.454 ' CE1' ' HB3' ' A' ' 42' ' ' ARG . 32.1 t80 -51.71 -38.36 54.86 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.547 ' O ' ' N ' ' A' ' 39' ' ' GLN . 32.1 t80 -64.28 -43.72 93.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.465 -0.772 . . . . 0.0 110.118 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.521 ' HD2' ' CD1' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -60.44 -21.92 62.84 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 119.988 -1.695 . . . . 0.0 110.059 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.522 ' CD1' ' N ' ' A' ' 37' ' ' LEU . 0.5 OUTLIER -84.74 -59.18 2.43 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.074 -1.016 . . . . 0.0 110.087 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -93.03 -28.48 16.36 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.21 -0.931 . . . . 0.0 109.695 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 35' ' ' TYR . 4.7 tt0 61.86 47.8 5.8 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 122.262 1.029 . . . . 0.0 109.999 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -141.17 168.56 15.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -71.4 125.75 27.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.788 -1.195 . . . . 0.0 108.429 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.512 ' HD3' ' HA ' ' A' ' 31' ' ' CYS . 1.8 ptm180 -95.5 146.99 32.3 Favored Pre-proline 0 N--CA 1.493 1.706 0 O-C-N 121.229 -0.919 . . . . 0.0 109.496 -178.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -62.71 133.53 42.66 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 C-N-CA 122.196 1.93 . . . . 0.0 110.565 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.51 -6.93 53.95 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.468 -0.77 . . . . 0.0 110.375 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.6 t -60.66 -28.09 68.31 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.12 -0.987 . . . . 0.0 110.798 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -77.54 -21.44 52.6 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.916 -1.115 . . . . 0.0 110.178 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.546 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -76.08 149.72 37.41 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.022 -1.049 . . . . 0.0 108.997 179.417 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.41 ' N ' ' HG2' ' A' ' 47' ' ' ARG . 34.8 mttm -124.84 -166.07 1.48 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.016 -1.052 . . . . 0.0 110.013 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -91.69 -45.56 8.38 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.072 -1.017 . . . . 0.0 109.9 -179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -95.08 135.46 12.42 Favored Glycine 0 N--CA 1.499 2.873 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.416 HG22 HD12 ' A' ' 51' ' ' ILE . 4.8 mt -50.62 120.97 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.164 -1.197 . . . . 0.0 109.802 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -63.39 151.14 41.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.632 -0.667 . . . . 0.0 109.895 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.436 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -156.32 154.98 31.46 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.977 -1.077 . . . . 0.0 109.366 178.853 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 53' ' ' THR . 5.9 mtp180 -150.89 -161.87 1.43 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -53.25 130.73 35.67 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.928 -1.107 . . . . 0.0 109.136 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.3 mtt180 -76.14 160.43 29.75 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.418 -0.801 . . . . 0.0 110.125 -179.053 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.692 0 O-C-N 121.358 -0.839 . . . . 0.0 109.722 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.51 -30.66 9.2 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 109.211 -1.555 . . . . 0.0 109.211 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.442 HG21 ' HB2' ' A' ' 26' ' ' PRO . 15.5 m -70.77 89.09 0.74 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -1.17 . . . . 0.0 109.627 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.3 m -97.06 124.11 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 7.9 t -43.66 113.99 0.58 Allowed 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.395 -0.816 . . . . 0.0 111.269 -178.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.3 m -59.62 -10.65 3.75 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.106 -0.996 . . . . 0.0 111.178 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -110.4 -28.66 8.46 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.812 -1.18 . . . . 0.0 110.956 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.54 ' O ' ' HD3' ' A' ' 47' ' ' ARG . 2.4 p -138.32 21.97 2.77 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 120.877 -1.139 . . . . 0.0 110.159 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER 30.53 37.57 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 179.272 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.459 HG22 ' HB2' ' A' ' 7' ' ' CYS . 14.9 t -90.83 126.22 35.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.783 -1.198 . . . . 0.0 109.072 178.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 p -89.66 -15.01 33.6 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.51 -0.744 . . . . 0.0 109.699 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -102.7 99.77 9.76 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.287 -0.883 . . . . 0.0 109.386 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.471 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 6.5 p -122.6 163.05 20.71 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.175 -0.953 . . . . 0.0 110.292 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.447 HG21 HG22 ' A' ' 51' ' ' ILE . 81.9 p -94.11 -32.17 13.87 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.638 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 67.5 mt -142.75 87.23 1.98 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.317 -0.864 . . . . 0.0 109.263 179.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.471 ' CZ2' HG23 ' A' ' 15' ' ' THR . 13.1 m95 -54.54 109.27 0.48 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.077 -1.014 . . . . 0.0 110.162 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.513 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -101.66 130.23 47.98 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.348 -0.845 . . . . 0.0 109.018 179.658 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.9 mmt180 -97.27 109.62 22.34 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.248 -0.908 . . . . 0.0 108.875 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.74 146.5 98.49 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.177 -0.952 . . . . 0.0 109.392 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -58.1 -21.09 49.17 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 C-N-CA 122.2 1.934 . . . . 0.0 110.613 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 10.8 mtt -81.54 -0.96 44.43 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.317 -0.864 . . . . 0.0 109.788 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.89 35.43 7.73 Favored Glycine 0 N--CA 1.497 2.711 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -124.22 105.24 31.47 Favored Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.386 -1.067 . . . . 0.0 110.524 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.442 ' HB2' HG21 ' A' ' 5' ' ' THR . 1.5 Cg_endo -66.63 93.27 0.31 Allowed 'Trans proline' 0 C--N 1.314 -1.27 0 C-N-CA 122.235 1.957 . . . . 0.0 109.579 178.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.534 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -109.75 124.47 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 121.107 -0.996 . . . . 0.0 110.561 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.402 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.4 p -45.97 131.43 9.72 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.753 -0.592 . . . . 0.0 110.398 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.638 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 7.2 t-20 -36.63 -45.56 0.53 Allowed 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.708 -0.62 . . . . 0.0 111.934 -178.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.24 -49.05 34.77 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.563 -0.711 . . . . 0.0 109.93 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.604 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 8.9 m -59.65 -46.35 89.27 Favored 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -55.03 -54.6 32.83 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.515 ' O ' HD12 ' A' ' 37' ' ' LEU . 96.0 mt -59.23 -57.62 12.24 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.644 -0.915 . . . . 0.0 109.594 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.412 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 30.6 t80 -43.8 -36.4 2.29 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.339 -0.851 . . . . 0.0 109.59 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.49 ' O ' ' N ' ' A' ' 39' ' ' GLN . 38.7 t80 -58.82 -52.81 64.12 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.333 -0.854 . . . . 0.0 109.722 178.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -65.65 -26.97 68.05 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.964 -1.085 . . . . 0.0 110.483 -179.945 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 33' ' ' LEU . 9.8 mp -53.53 -57.69 9.82 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.215 -0.928 . . . . 0.0 109.285 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.489 ' CB ' HG21 ' A' ' 40' ' ' VAL . 76.8 m-70 -113.79 11.65 18.07 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.18 -0.95 . . . . 0.0 109.771 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.49 ' N ' ' O ' ' A' ' 35' ' ' TYR . 4.9 tm0? 51.92 30.93 7.77 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.362 -0.836 . . . . 0.0 110.018 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.489 HG21 ' CB ' ' A' ' 38' ' ' HIS . 3.2 m -131.38 -171.29 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.35 -0.844 . . . . 0.0 109.516 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -66.72 -173.2 0.21 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.249 -0.907 . . . . 0.0 110.105 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.604 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -142.78 116.62 6.3 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.102 -0.999 . . . . 0.0 109.702 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -63.37 147.79 93.25 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 C-N-CA 122.069 1.846 . . . . 0.0 110.302 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.37 16.71 9.61 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.199 -0.938 . . . . 0.0 110.392 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.06 -12.95 60.21 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.054 -1.029 . . . . 0.0 109.858 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' MET . . . . . 0.417 ' O ' ' HG3' ' A' ' 46' ' ' MET . 0.0 OUTLIER -89.36 -5.23 57.65 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.034 -1.041 . . . . 0.0 110.664 179.632 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 10' ' ' CYS . 65.6 mtm180 -57.27 165.25 1.48 Allowed 'General case' 0 N--CA 1.504 2.236 0 O-C-N 120.65 -1.281 . . . . 0.0 110.571 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.22 145.62 31.39 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.421 -0.799 . . . . 0.0 109.926 179.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -47.6 -36.57 10.96 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.636 -0.665 . . . . 0.0 110.01 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.0 146.84 18.76 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 108.48 -1.848 . . . . 0.0 108.48 179.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.447 HG22 HG21 ' A' ' 16' ' ' THR . 5.3 mt -46.73 114.79 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 121.474 -1.015 . . . . 0.0 110.016 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -51.55 142.32 14.37 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.579 -0.701 . . . . 0.0 109.497 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.36 159.09 39.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.96 -1.087 . . . . 0.0 110.054 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.57 -157.65 0.83 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -62.74 97.18 0.1 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 120.884 -1.135 . . . . 0.0 108.726 179.048 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 0.2 OUTLIER -45.06 143.59 1.51 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.678 -0.639 . . . . 0.0 110.473 -179.114 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.887 0 O-C-N 121.397 -0.814 . . . . 0.0 110.086 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.32 -19.67 50.99 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.554 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 54.5 m -69.19 87.84 0.42 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.049 -1.266 . . . . 0.0 109.249 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 34.6 m -78.8 110.12 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.511 ' CB ' HG23 ' A' ' 12' ' ' THR . 41.0 t -47.44 109.44 0.22 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.262 -0.899 . . . . 0.0 110.391 -178.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 24.7 m -59.39 -12.49 6.03 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.326 -0.859 . . . . 0.0 111.628 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -95.61 -28.84 14.64 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.612 -1.305 . . . . 0.0 111.059 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.624 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 15.0 p -142.37 17.22 2.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.863 -1.148 . . . . 0.0 111.494 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 4.3 mp0 53.43 18.65 1.4 Allowed 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.2 -0.937 . . . . 0.0 112.052 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.511 HG23 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -84.15 128.72 34.74 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.401 -1.437 . . . . 0.0 109.786 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.2 p -89.72 -28.46 19.39 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.444 -0.785 . . . . 0.0 109.533 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.414 ' HB ' HG13 ' A' ' 51' ' ' ILE . 27.9 p -93.32 127.44 38.92 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.547 HG21 ' CH2' ' A' ' 18' ' ' TRP . 4.8 p -146.44 145.49 30.25 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.034 -1.041 . . . . 0.0 110.097 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.1 p -68.0 -32.06 72.18 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.104 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.519 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 13.5 mt -149.03 122.6 9.15 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.332 -0.855 . . . . 0.0 109.57 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.547 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.8 m95 -80.89 109.13 15.17 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.302 -0.874 . . . . 0.0 110.255 -179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.09 78.69 4.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.39 -0.819 . . . . 0.0 108.904 179.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.8 122.9 15.99 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.216 -0.927 . . . . 0.0 109.872 -179.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.7 143.26 37.95 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.592 -0.693 . . . . 0.0 109.518 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -56.86 -38.82 94.98 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.496 2.13 . . . . 0.0 110.742 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.36 -23.73 50.83 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.405 -0.809 . . . . 0.0 109.586 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.78 39.06 1.63 Allowed Glycine 0 N--CA 1.496 2.658 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -133.18 97.15 16.73 Favored Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.397 -1.061 . . . . 0.0 110.177 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 2.9 Cg_endo -63.98 112.68 1.91 Allowed 'Trans proline' 0 C--N 1.312 -1.387 0 C-N-CA 122.091 1.861 . . . . 0.0 109.952 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.498 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 3.3 m -122.62 129.1 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.074 -1.017 . . . . 0.0 110.5 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.51 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.2 p -52.68 139.2 26.84 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 121.441 0.638 . . . . 0.0 110.559 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.519 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 19.7 t-20 -40.35 -47.78 2.58 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.88 -0.512 . . . . 0.0 112.071 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.43 -41.68 52.91 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.195 -0.941 . . . . 0.0 110.355 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.42 ' HB3' ' HD2' ' A' ' 42' ' ' ARG . 9.6 m -66.77 -36.81 83.29 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.156 -0.965 . . . . 0.0 108.526 178.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.81 -48.79 59.24 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 93.8 mt -61.04 -59.44 5.36 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.583 -0.951 . . . . 0.0 109.619 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.471 ' CD1' ' HB3' ' A' ' 42' ' ' ARG . 18.4 t80 -47.97 -40.35 22.07 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.564 -0.71 . . . . 0.0 109.515 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.432 ' HB2' ' NH1' ' A' ' 42' ' ' ARG . 41.4 t80 -58.33 -49.9 75.53 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.313 -0.867 . . . . 0.0 109.62 179.209 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 tttt -61.14 -34.66 75.36 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.979 -1.076 . . . . 0.0 109.945 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.424 ' N ' HD13 ' A' ' 37' ' ' LEU . 9.1 mp -53.62 -63.27 1.2 Allowed 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.657 -0.652 . . . . 0.0 110.682 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.535 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 83.1 m-70 -105.93 12.58 30.44 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.121 -0.987 . . . . 0.0 110.39 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER 47.42 28.35 1.1 Allowed 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 121.614 0.721 . . . . 0.0 110.895 -179.327 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.434 HG21 ' CB ' ' A' ' 38' ' ' HIS . 8.2 m -130.96 -170.45 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 O-C-N 121.203 -0.936 . . . . 0.0 109.873 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -62.47 -177.27 0.13 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.497 -0.752 . . . . 0.0 109.853 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.471 ' HB3' ' CD1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -146.28 111.17 4.33 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 120.902 -1.124 . . . . 0.0 110.179 -179.524 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -60.15 134.04 53.56 Favored 'Trans proline' 0 C--N 1.316 -1.157 0 C-N-CA 122.115 1.877 . . . . 0.0 110.298 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.624 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 1.2 pp -88.8 9.93 22.83 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.303 -0.873 . . . . 0.0 110.835 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 43.7 p -70.36 -9.93 57.6 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.064 -1.022 . . . . 0.0 110.569 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 ttt -95.77 -22.05 17.75 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.94 -1.1 . . . . 0.0 110.531 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.441 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -67.27 152.02 46.47 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.829 -1.169 . . . . 0.0 110.055 -179.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.402 ' HB2' ' OE1' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -106.94 -160.52 0.74 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.379 -0.826 . . . . 0.0 109.716 179.836 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -47.67 -73.2 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.264 -0.897 . . . . 0.0 110.698 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -136.48 -158.52 8.09 Favored Glycine 0 N--CA 1.498 2.778 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.414 HG13 ' HB ' ' A' ' 14' ' ' THR . 9.3 mt -50.91 111.15 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.223 -1.163 . . . . 0.0 110.033 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.402 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -78.16 156.45 29.87 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.423 -0.798 . . . . 0.0 109.213 179.612 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -154.99 163.05 40.85 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.137 -0.977 . . . . 0.0 109.718 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.85 -168.77 3.2 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.04 124.88 23.75 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.944 -1.097 . . . . 0.0 108.99 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.5 mtt180 -53.22 136.84 35.72 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.438 -0.789 . . . . 0.0 110.07 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.729 0 O-C-N 121.538 -0.727 . . . . 0.0 109.799 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.828 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.31 -22.57 32.5 Favored Glycine 0 N--CA 1.498 2.806 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 -179.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.457 HG23 ' CZ3' ' A' ' 18' ' ' TRP . 26.4 m -66.9 99.87 0.67 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.121 -1.223 . . . . 0.0 109.717 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.435 ' O ' HG22 ' A' ' 6' ' ' VAL . 6.8 m -97.82 104.32 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.584 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 42.3 t -40.72 106.88 0.06 Allowed 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.719 -0.613 . . . . 0.0 110.549 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.4 m -57.31 -17.22 11.16 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.554 -0.716 . . . . 0.0 111.595 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.513 ' HB2' HG13 ' A' ' 27' ' ' VAL . 5.3 m120 -95.43 -30.91 13.63 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.654 -1.278 . . . . 0.0 111.419 -179.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.487 ' O ' ' CD ' ' A' ' 47' ' ' ARG . 13.3 p -133.15 17.94 4.08 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.557 -1.34 . . . . 0.0 111.06 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 7' ' ' CYS . 26.4 mt-30 44.67 31.78 0.69 Allowed 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.318 -0.863 . . . . 0.0 112.108 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.515 HG23 HG23 ' A' ' 15' ' ' THR . 3.2 t -90.61 127.38 36.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.655 -1.278 . . . . 0.0 109.376 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.21 -20.48 24.13 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.578 -0.701 . . . . 0.0 109.29 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.7 p -106.79 133.86 50.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.209 -0.932 . . . . 0.0 109.021 179.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.515 HG23 HG23 ' A' ' 12' ' ' THR . 8.0 p -146.06 156.59 43.57 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.219 -0.926 . . . . 0.0 110.502 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 43.4 p -87.02 -29.59 21.85 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.647 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 24.5 mt -146.33 91.01 2.0 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.282 -0.886 . . . . 0.0 109.289 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.51 ' CZ2' HG22 ' A' ' 15' ' ' THR . 9.8 m95 -54.7 102.67 0.07 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.947 -1.095 . . . . 0.0 109.545 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -101.13 95.22 6.41 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.454 -0.779 . . . . 0.0 110.128 -178.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 26' ' ' PRO . 9.3 mmt180 -62.74 110.29 1.69 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.194 -0.942 . . . . 0.0 108.895 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.5 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -71.6 137.78 83.25 Favored Pre-proline 0 N--CA 1.496 1.862 0 O-C-N 121.195 -0.941 . . . . 0.0 110.182 -179.221 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -56.39 -29.59 77.92 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 C-N-CA 122.701 2.267 . . . . 0.0 110.832 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 18.9 ttm -54.88 -25.25 27.68 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.577 -0.702 . . . . 0.0 109.483 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.43 30.92 2.94 Favored Glycine 0 N--CA 1.497 2.726 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -140.27 124.34 10.7 Favored Pre-proline 0 N--CA 1.493 1.678 0 O-C-N 121.165 -1.197 . . . . 0.0 110.107 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.525 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.7 Cg_endo -65.94 104.16 0.67 Allowed 'Trans proline' 0 C--N 1.314 -1.275 0 C-N-CA 122.143 1.895 . . . . 0.0 109.805 179.293 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.584 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -117.3 127.27 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-O 122.156 0.979 . . . . 0.0 110.731 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.0 p -48.97 138.32 11.72 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.726 -0.609 . . . . 0.0 109.594 179.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.647 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 1.6 t-20 -44.68 -33.3 1.79 Allowed 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.519 -0.738 . . . . 0.0 110.779 -179.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.63 -48.44 72.26 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.088 -1.008 . . . . 0.0 109.584 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.454 ' SG ' ' HD3' ' A' ' 42' ' ' ARG . 26.8 m -64.18 -39.11 93.31 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.434 -0.791 . . . . 0.0 109.382 179.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.54 -28.65 72.09 Favored Glycine 0 N--CA 1.496 2.633 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.536 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 42.5 mt -76.91 -70.1 0.48 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.319 -1.107 . . . . 0.0 110.387 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.432 ' CD1' ' C ' ' A' ' 34' ' ' TYR . 7.7 t80 -43.83 -35.59 1.99 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.352 -0.843 . . . . 0.0 109.146 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.541 ' O ' ' HA ' ' A' ' 39' ' ' GLN . 28.6 t80 -58.55 -51.92 67.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.481 -0.762 . . . . 0.0 110.527 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.536 ' HD3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -59.59 -22.43 61.76 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.392 -1.442 . . . . 0.0 110.723 -179.534 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.484 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 1.9 mp -73.73 -69.32 0.44 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.41 -0.806 . . . . 0.0 110.249 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.522 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 35.5 m-70 -100.96 15.08 29.8 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.282 -0.886 . . . . 0.0 110.191 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.541 ' HA ' ' O ' ' A' ' 35' ' ' TYR . 4.4 pm0 36.86 43.88 0.32 Allowed 'General case' 0 N--CA 1.503 2.203 0 CA-C-O 121.547 0.689 . . . . 0.0 111.45 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.428 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.2 m -132.92 178.4 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 O-C-N 121.434 -0.792 . . . . 0.0 109.989 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -70.4 172.95 7.49 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.286 -0.883 . . . . 0.0 110.475 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.454 ' HD3' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -131.83 131.73 22.85 Favored Pre-proline 0 N--CA 1.501 2.123 0 O-C-N 121.306 -0.871 . . . . 0.0 109.226 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.413 ' HB2' HG22 ' A' ' 45' ' ' THR . 3.3 Cg_endo -68.44 146.56 68.77 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 122.492 2.128 . . . . 0.0 111.674 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.486 ' O ' ' HB3' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -92.93 -3.24 54.88 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.617 -0.677 . . . . 0.0 110.061 178.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' THR . . . . . 0.413 HG22 ' HB2' ' A' ' 43' ' ' PRO . 2.2 t -63.69 -35.78 81.67 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.914 -1.116 . . . . 0.0 110.281 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 5.4 ttt -84.38 8.56 15.79 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.99 -1.069 . . . . 0.0 110.076 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.487 ' CD ' ' O ' ' A' ' 10' ' ' CYS . 0.3 OUTLIER -75.08 157.38 34.85 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.859 -1.15 . . . . 0.0 109.907 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -139.33 146.83 40.77 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.247 -0.908 . . . . 0.0 109.232 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.89 -39.15 93.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.859 . . . . 0.0 109.625 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -98.11 130.66 10.31 Favored Glycine 0 N--CA 1.495 2.632 0 N-CA-C 109.026 -1.629 . . . . 0.0 109.026 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.3 mt -45.93 113.13 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.664 -0.904 . . . . 0.0 109.921 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -55.17 149.77 11.91 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.689 -0.632 . . . . 0.0 110.309 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.88 160.94 40.59 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.129 -0.982 . . . . 0.0 109.462 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -151.5 -161.64 1.37 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.655 -0.653 . . . . 0.0 109.858 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -55.99 133.66 51.85 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.074 -1.016 . . . . 0.0 108.949 179.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -61.32 158.99 13.17 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 121.607 0.718 . . . . 0.0 110.199 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.4 ttmt . . . . . 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 0.0 110.0 179.796 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 121.101 0.477 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 53.42 36.64 53.94 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.449 ' O ' ' CH2' ' A' ' 18' ' ' TRP . 25.2 m -55.45 94.54 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.553 -0.969 . . . . 0.0 109.857 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.4 m -89.95 112.31 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.539 ' HB3' HG21 ' A' ' 12' ' ' THR . 38.7 t -44.18 109.44 0.15 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.498 -0.751 . . . . 0.0 110.669 -178.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.7 m -57.73 -20.08 32.12 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.11 -0.994 . . . . 0.0 111.72 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.425 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 9.4 m-20 -85.67 -30.74 22.96 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.951 -1.093 . . . . 0.0 110.786 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.539 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 18.6 p -141.86 24.84 2.0 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.666 -1.271 . . . . 0.0 111.103 179.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.512 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 40.36 26.95 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.786 -0.571 . . . . 0.0 111.936 179.811 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.539 HG21 ' HB3' ' A' ' 7' ' ' CYS . 5.7 t -85.65 130.13 34.65 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.779 -1.201 . . . . 0.0 109.531 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -90.66 6.12 45.21 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.533 -0.73 . . . . 0.0 109.292 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.469 ' HB ' ' CG1' ' A' ' 51' ' ' ILE . 14.5 p -125.82 124.55 41.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.259 -0.901 . . . . 0.0 109.57 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.586 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 9.6 p -145.3 146.44 31.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.036 -1.04 . . . . 0.0 110.387 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.413 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 22.5 p -67.04 -38.54 86.07 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.413 ' HG ' ' O ' ' A' ' 16' ' ' THR . 11.6 mt -149.86 107.61 3.68 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.586 ' CZ2' HG23 ' A' ' 15' ' ' THR . 40.9 m95 -59.27 94.83 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.515 -0.74 . . . . 0.0 110.262 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.04 87.67 5.42 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.371 -0.83 . . . . 0.0 108.951 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.11 102.8 0.32 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.402 -0.811 . . . . 0.0 109.43 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.1 t -67.59 136.98 93.02 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.351 -0.843 . . . . 0.0 110.169 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -58.98 -30.12 92.45 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 C-N-CA 122.625 2.217 . . . . 0.0 110.924 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -57.67 -24.91 59.15 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.223 -0.923 . . . . 0.0 109.281 179.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 113.2 33.9 1.89 Allowed Glycine 0 N--CA 1.496 2.666 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -136.77 109.27 9.25 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.21 -1.171 . . . . 0.0 110.596 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.516 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 5.8 Cg_exo -62.36 102.6 0.28 Allowed 'Trans proline' 0 C--N 1.315 -1.21 0 C-N-CA 122.155 1.903 . . . . 0.0 109.464 178.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.466 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -111.69 155.89 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 120.977 -1.077 . . . . 0.0 110.943 -179.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.507 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 15.3 p -82.32 139.58 34.06 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -38.04 -44.23 0.79 Allowed 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.762 -0.586 . . . . 0.0 111.413 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.28 -48.62 76.24 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.24 -0.912 . . . . 0.0 111.239 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 3.6 m -56.29 -49.78 73.29 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.265 -0.897 . . . . 0.0 108.663 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.09 -38.46 93.07 Favored Glycine 0 N--CA 1.494 2.554 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 44.8 mt -67.72 -67.75 0.44 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.492 -1.005 . . . . 0.0 110.13 -180.0 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -52.74 -37.36 59.18 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.445 -0.785 . . . . 0.0 109.256 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' A' ' 39' ' ' GLN . 43.3 t80 -60.74 -45.65 93.46 Favored 'General case' 0 C--O 1.2 -1.523 0 O-C-N 121.414 -0.804 . . . . 0.0 108.917 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.39 -29.74 61.86 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.194 -1.566 . . . . 0.0 110.06 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 mp -64.74 -65.82 0.62 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.945 -1.097 . . . . 0.0 110.122 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -94.61 -32.73 13.28 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.228 -0.92 . . . . 0.0 109.977 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.575 ' N ' ' O ' ' A' ' 35' ' ' TYR . 21.7 tt0 72.87 46.09 0.27 Allowed 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 121.734 0.778 . . . . 0.0 110.577 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 m -140.34 167.69 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 121.395 -0.815 . . . . 0.0 109.219 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -85.16 129.88 34.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.065 -1.022 . . . . 0.0 109.036 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -130.17 146.38 61.31 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.188 -0.945 . . . . 0.0 109.882 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.0 144.31 99.48 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 C-N-CA 122.622 2.215 . . . . 0.0 111.314 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.539 ' HB3' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -78.89 48.01 0.8 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.121 -0.987 . . . . 0.0 110.739 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.5 t -66.31 -12.19 55.15 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.133 -0.98 . . . . 0.0 110.141 178.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -103.32 -2.28 27.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.988 -1.07 . . . . 0.0 110.565 179.489 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.491 ' HD3' ' HB2' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -67.1 157.93 32.4 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.631 -1.293 . . . . 0.0 110.256 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.0 mttt -143.51 -163.84 1.74 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.586 -0.696 . . . . 0.0 109.487 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.53 -74.01 0.3 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.211 -0.931 . . . . 0.0 110.015 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.45 161.74 26.44 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.469 ' CG1' ' HB ' ' A' ' 14' ' ' THR . 7.6 mt -55.32 135.43 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.238 -1.154 . . . . 0.0 110.096 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -69.87 150.02 47.24 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.363 -0.836 . . . . 0.0 109.248 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.63 160.85 40.76 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.112 -0.993 . . . . 0.0 109.763 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -151.21 175.96 11.67 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -63.49 93.05 0.07 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -47.55 130.22 13.86 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.662 -0.649 . . . . 0.0 110.503 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.022 0 O-C-N 121.688 -0.633 . . . . 0.0 110.069 -179.791 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.843 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.46 -35.58 2.89 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.477 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 3.5 m -64.68 93.77 0.11 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.282 -1.128 . . . . 0.0 109.094 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.8 m -98.65 137.64 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.573 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 9.4 t -56.16 117.61 3.92 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.47 -0.769 . . . . 0.0 110.659 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -58.52 -16.28 14.78 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.466 -0.771 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.475 ' OD1' ' HD3' ' A' ' 42' ' ' ARG . 4.5 m-80 -109.42 -24.96 10.77 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.923 -1.111 . . . . 0.0 111.569 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.493 ' SG ' HG23 ' A' ' 12' ' ' THR . 4.8 p -140.23 19.82 2.42 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.491 -1.38 . . . . 0.0 111.466 179.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 39.24 34.81 0.13 Allowed 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.554 -0.716 . . . . 0.0 112.841 178.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.517 HG23 ' HB2' ' A' ' 7' ' ' CYS . 11.0 t -89.18 132.49 34.82 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.61 -1.306 . . . . 0.0 108.822 178.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.74 -25.11 18.34 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.471 -0.768 . . . . 0.0 110.191 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.488 ' HB ' HG13 ' A' ' 51' ' ' ILE . 68.9 p -103.88 114.8 29.32 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.167 -0.958 . . . . 0.0 109.209 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.2 p -130.4 161.55 31.1 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 119.664 -0.814 . . . . 0.0 110.594 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.4 p -82.8 -36.46 25.56 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 17.8 mt -143.05 106.09 4.54 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.887 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.477 ' CZ2' HG23 ' A' ' 5' ' ' THR . 16.3 m95 -64.27 107.21 1.26 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.373 -0.829 . . . . 0.0 110.391 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.557 ' HB3' HG21 ' A' ' 27' ' ' VAL . 6.8 tpt180 -81.66 72.97 8.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 108.719 179.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.439 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 10.7 tpp180 -63.52 92.42 0.06 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.0 143.79 91.51 Favored Pre-proline 0 N--CA 1.499 1.979 0 O-C-N 121.338 -0.851 . . . . 0.0 110.354 -178.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -54.5 -42.56 66.94 Favored 'Trans proline' 0 C--N 1.32 -0.967 0 C-N-CA 122.632 2.221 . . . . 0.0 111.09 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -21.16 58.58 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.283 -0.886 . . . . 0.0 109.972 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.34 42.13 1.19 Allowed Glycine 0 N--CA 1.497 2.719 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -128.7 92.82 39.28 Favored Pre-proline 0 N--CA 1.493 1.687 0 O-C-N 121.373 -1.075 . . . . 0.0 110.091 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.492 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.3 Cg_endo -64.35 95.2 0.21 Allowed 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 122.51 2.14 . . . . 0.0 110.003 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.573 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.05 123.26 69.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.071 -1.018 . . . . 0.0 110.655 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.5 p -45.63 132.62 8.36 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.27 -0.894 . . . . 0.0 109.947 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -37.48 -42.45 0.52 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.61 -0.681 . . . . 0.0 111.825 -178.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.78 -46.29 50.58 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.24 -0.913 . . . . 0.0 110.217 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 33.0 m -66.75 -33.61 76.02 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.327 -0.858 . . . . 0.0 109.352 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.01 -38.61 95.66 Favored Glycine 0 N--CA 1.493 2.468 0 N-CA-C 109.156 -1.577 . . . . 0.0 109.156 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.497 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 95.2 mt -73.09 -58.01 3.62 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.526 -0.985 . . . . 0.0 110.045 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.414 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 29.6 t80 -46.14 -37.34 6.82 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.198 -0.938 . . . . 0.0 109.559 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.518 ' O ' ' N ' ' A' ' 39' ' ' GLN . 18.5 t80 -60.7 -55.42 33.4 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.37 -0.831 . . . . 0.0 110.413 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -57.29 -24.1 52.74 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.575 -1.328 . . . . 0.0 110.802 -179.556 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.463 HD13 ' HG3' ' A' ' 36' ' ' LYS . 5.7 mp -65.3 -67.19 0.46 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.345 -0.847 . . . . 0.0 109.823 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.519 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 66.1 m-70 -97.16 -29.5 13.56 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.295 -0.878 . . . . 0.0 110.395 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.519 ' CG ' ' O ' ' A' ' 38' ' ' HIS . 0.1 OUTLIER 87.4 27.5 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.571 0 CA-C-O 121.609 0.719 . . . . 0.0 110.574 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 m -124.63 -171.0 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.078 -1.014 . . . . 0.0 109.629 179.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.17 175.64 0.21 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.058 -1.027 . . . . 0.0 109.378 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.475 ' HD3' ' OD1' ' A' ' 9' ' ' ASN . 1.6 mpt_? -119.8 132.86 23.9 Favored Pre-proline 0 N--CA 1.495 1.804 0 O-C-N 120.909 -1.119 . . . . 0.0 109.805 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -62.8 126.32 17.9 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 C-N-CA 122.39 2.06 . . . . 0.0 110.965 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.433 ' HB3' ' HA ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -94.16 -19.72 20.52 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.422 -0.799 . . . . 0.0 110.123 179.521 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.22 -34.33 70.3 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.218 -0.926 . . . . 0.0 110.423 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -74.74 -29.81 61.29 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.243 -0.911 . . . . 0.0 109.482 179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.49 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -64.16 141.75 58.66 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.365 -0.835 . . . . 0.0 109.34 179.795 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 tttt -104.42 178.27 4.61 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.282 -0.886 . . . . 0.0 110.15 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -74.94 -33.69 61.98 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.338 -0.852 . . . . 0.0 110.265 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -114.09 149.03 18.77 Favored Glycine 0 N--CA 1.497 2.757 0 N-CA-C 109.079 -1.609 . . . . 0.0 109.079 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.488 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.2 mt -46.35 107.77 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.545 -0.974 . . . . 0.0 110.128 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -52.3 147.59 7.67 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.34 161.75 40.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.49 -1.381 . . . . 0.0 109.984 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.46 -152.37 0.43 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -60.02 114.31 2.77 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.808 -1.182 . . . . 0.0 107.944 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -47.17 133.71 11.59 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.665 -0.647 . . . . 0.0 109.864 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp . . . . . 0 N--CA 1.498 1.937 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.451 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.836 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.79 -30.38 9.84 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 92.7 m -72.61 89.1 1.29 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.188 -1.183 . . . . 0.0 109.579 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 32.7 m -85.61 122.13 38.04 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 53.4 t -56.02 113.9 1.71 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.932 -1.105 . . . . 0.0 110.05 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -60.8 -12.96 12.41 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.366 -0.833 . . . . 0.0 111.24 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -99.13 -31.22 11.86 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.82 -1.175 . . . . 0.0 110.702 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.487 ' SG ' ' HD3' ' A' ' 47' ' ' ARG . 15.0 p -139.42 24.26 2.48 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.56 -1.338 . . . . 0.0 111.424 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 43.04 23.9 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.215 -0.928 . . . . 0.0 112.71 178.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.488 HG23 ' HB2' ' A' ' 7' ' ' CYS . 5.5 t -86.83 132.1 33.93 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.373 -1.454 . . . . 0.0 110.236 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.35 -25.62 19.31 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.6 p -97.39 117.58 31.94 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.326 -0.859 . . . . 0.0 109.374 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.488 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 18.0 p -132.43 156.04 47.42 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.157 -0.965 . . . . 0.0 111.004 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.409 HG23 ' CG2' ' A' ' 51' ' ' ILE . 28.6 p -83.22 -40.93 18.99 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.569 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 16.6 mt -139.56 92.36 2.56 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 179.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.488 ' CZ2' HG23 ' A' ' 15' ' ' THR . 10.5 m95 -57.6 127.97 34.72 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.195 -0.94 . . . . 0.0 110.148 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -116.16 86.07 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.379 -0.826 . . . . 0.0 109.122 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 12.8 mmm180 -62.63 102.73 0.36 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.371 -0.831 . . . . 0.0 109.314 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.481 ' HB2' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -63.65 143.57 97.95 Favored Pre-proline 0 N--CA 1.498 1.941 0 O-C-N 121.165 -0.959 . . . . 0.0 110.263 -179.292 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -53.99 -44.01 53.11 Favored 'Trans proline' 0 C--N 1.318 -1.03 0 C-N-CA 122.866 2.377 . . . . 0.0 111.26 -179.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -22.12 45.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.313 -0.867 . . . . 0.0 109.941 179.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.0 38.35 1.41 Allowed Glycine 0 N--CA 1.497 2.759 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 21' ' ' SER . 15.8 m-20 -128.51 98.21 26.13 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.324 -1.104 . . . . 0.0 110.082 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.485 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.9 Cg_endo -64.83 101.5 0.39 Allowed 'Trans proline' 0 C--N 1.311 -1.411 0 C-N-CA 121.956 1.771 . . . . 0.0 109.866 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.492 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -115.01 126.29 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.209 -0.932 . . . . 0.0 110.281 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.8 p -50.4 135.69 21.69 Favored 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.698 -0.626 . . . . 0.0 109.421 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.569 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t-20 -38.17 -43.81 0.8 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.564 -0.71 . . . . 0.0 111.384 -178.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.15 -45.31 33.12 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.525 -0.735 . . . . 0.0 110.359 -179.749 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 51.3 m -70.3 -35.45 73.71 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.436 -0.79 . . . . 0.0 109.556 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.77 -31.73 81.87 Favored Glycine 0 N--CA 1.496 2.658 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.417 HD12 ' OD1' ' A' ' 29' ' ' ASN . 96.8 mt -79.25 -61.22 2.08 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.248 -1.148 . . . . 0.0 110.079 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.556 ' CE2' ' HB2' ' A' ' 42' ' ' ARG . 33.1 t80 -50.79 -36.03 34.94 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.379 -0.826 . . . . 0.0 108.886 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.561 ' O ' ' N ' ' A' ' 39' ' ' GLN . 18.5 t80 -59.45 -53.68 55.34 Favored 'General case' 0 C--O 1.199 -1.559 0 O-C-N 121.54 -0.725 . . . . 0.0 109.669 179.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HD3' HD11 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -55.02 -27.41 44.19 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 119.918 -1.739 . . . . 0.0 110.267 179.616 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.506 HD11 ' HD3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -66.57 -71.14 0.21 Allowed 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.896 -1.128 . . . . 0.0 109.92 179.614 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -96.19 -28.6 14.48 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.204 -0.935 . . . . 0.0 109.56 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.561 ' N ' ' O ' ' A' ' 35' ' ' TYR . 21.5 tt0 73.3 52.43 0.13 Allowed 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 122.163 0.983 . . . . 0.0 110.336 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.3 m -141.34 170.49 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -78.54 126.04 30.2 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.814 -1.179 . . . . 0.0 109.981 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.556 ' HB2' ' CE2' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -102.57 131.86 21.94 Favored Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.037 -1.04 . . . . 0.0 109.77 -179.55 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -64.51 150.66 87.85 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.283 1.989 . . . . 0.0 110.334 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.461 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -84.67 30.77 0.55 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.002 -1.061 . . . . 0.0 110.406 179.699 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.8 p -70.68 -17.14 62.85 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.129 -0.982 . . . . 0.0 109.948 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.56 1.68 51.57 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.987 -1.071 . . . . 0.0 110.428 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -79.05 166.45 22.3 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 120.807 -1.183 . . . . 0.0 109.706 179.655 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 tptt -134.42 -172.55 3.04 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.36 -0.837 . . . . 0.0 109.469 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -59.85 -50.71 72.72 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.309 -0.869 . . . . 0.0 110.027 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.11 171.77 15.82 Favored Glycine 0 N--CA 1.494 2.501 0 N-CA-C 109.446 -1.462 . . . . 0.0 109.446 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.409 ' CG2' HG23 ' A' ' 16' ' ' THR . 5.3 mt -49.55 125.72 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.488 -1.007 . . . . 0.0 109.995 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.25 154.81 41.36 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.554 -0.716 . . . . 0.0 110.203 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -156.32 154.08 30.04 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.458 ' HG2' ' NH1' ' A' ' 54' ' ' ARG . 0.4 OUTLIER -151.67 -164.94 2.1 Favored 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -65.57 89.74 0.11 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.995 -1.066 . . . . 0.0 108.158 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.77 175.52 1.45 Allowed 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.564 0.697 . . . . 0.0 110.365 -178.903 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.626 -0.671 . . . . 0.0 109.608 179.373 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.737 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.22 -14.77 6.52 Favored Glycine 0 N--CA 1.497 2.729 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 -179.082 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.503 HG22 ' CH2' ' A' ' 18' ' ' TRP . 4.3 m -62.81 89.36 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.085 -1.244 . . . . 0.0 109.631 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 35.0 m -82.48 114.27 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.538 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 45.3 t -49.35 110.08 0.33 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.253 -0.904 . . . . 0.0 110.468 -178.701 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.2 m -60.37 -13.22 11.99 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.171 -0.955 . . . . 0.0 111.149 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.494 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 1.0 OUTLIER -92.54 -30.96 15.39 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.822 -1.174 . . . . 0.0 110.69 -179.654 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.503 ' SG ' ' HD2' ' A' ' 47' ' ' ARG . 16.9 p -141.82 24.87 2.0 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.932 -1.105 . . . . 0.0 111.175 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 42.67 27.61 0.1 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.308 -0.87 . . . . 0.0 112.229 179.085 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.503 HG22 ' CB ' ' A' ' 7' ' ' CYS . 6.9 t -89.88 127.49 36.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.657 -1.277 . . . . 0.0 109.975 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -90.71 -12.59 36.19 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.534 -0.729 . . . . 0.0 109.63 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.424 ' HB ' HG13 ' A' ' 51' ' ' ILE . 30.0 p -113.35 126.1 55.0 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.213 -0.93 . . . . 0.0 108.576 179.219 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.545 HG21 ' CZ2' ' A' ' 18' ' ' TRP . 20.3 p -139.96 160.85 38.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.13 -0.981 . . . . 0.0 110.228 -179.238 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 44.6 p -91.67 -26.1 18.81 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.526 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.667 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 63.4 mt -144.09 87.45 1.9 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 179.506 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.545 ' CZ2' HG21 ' A' ' 15' ' ' THR . 6.0 m95 -57.44 106.72 0.36 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.075 -1.016 . . . . 0.0 110.543 -179.327 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.0 92.39 4.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.328 -0.858 . . . . 0.0 109.559 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.474 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 2.0 tmt_? -72.76 126.53 30.13 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.118 -0.989 . . . . 0.0 109.729 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.0 t -90.17 140.42 27.31 Favored Pre-proline 0 N--CA 1.497 1.906 0 O-C-N 121.334 -0.854 . . . . 0.0 109.782 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -55.89 -36.04 94.97 Favored 'Trans proline' 0 C--N 1.32 -0.944 0 C-N-CA 122.582 2.188 . . . . 0.0 110.908 -179.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.4 ttt -51.45 -24.9 5.51 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.517 -0.739 . . . . 0.0 109.833 178.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . 0.438 ' HA2' ' CZ ' ' A' ' 20' ' ' ARG . . . 111.22 28.51 3.8 Favored Glycine 0 N--CA 1.496 2.673 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 179.892 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -133.48 104.76 12.09 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.21 -1.17 . . . . 0.0 110.419 -179.574 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.474 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 2.8 Cg_endo -64.0 117.88 4.86 Favored 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.127 1.885 . . . . 0.0 109.66 178.674 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.538 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -127.58 125.24 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.055 -1.028 . . . . 0.0 110.64 -179.625 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.448 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 8.0 p -51.53 131.61 29.49 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 179.261 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.667 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 23.8 t-20 -39.63 -38.5 0.62 Allowed 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.633 -0.667 . . . . 0.0 111.34 -178.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.23 -43.27 61.42 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.255 -0.903 . . . . 0.0 110.279 179.565 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.494 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 12.5 m -66.92 -44.6 80.31 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.126 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.54 -31.28 77.1 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 179.128 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.45 ' O ' HD13 ' A' ' 37' ' ' LEU . 48.5 mt -72.83 -67.61 0.55 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.331 -1.1 . . . . 0.0 110.047 -179.564 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.409 ' CE1' ' CD2' ' A' ' 38' ' ' HIS . 62.4 t80 -49.6 -35.01 19.47 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.399 -0.813 . . . . 0.0 109.638 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.514 ' O ' ' N ' ' A' ' 39' ' ' GLN . 13.1 t80 -61.5 -51.45 68.6 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.389 -0.819 . . . . 0.0 109.877 179.439 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -55.02 -26.34 36.5 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.28 -1.512 . . . . 0.0 110.567 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 33' ' ' LEU . 5.0 mp -72.96 -65.16 0.83 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.098 -1.001 . . . . 0.0 110.719 -179.308 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.428 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 26.2 m-70 -97.76 -27.19 14.44 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.325 -0.859 . . . . 0.0 110.213 -179.471 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 77.22 31.75 0.48 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-O 121.652 0.739 . . . . 0.0 110.779 179.876 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.428 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.6 m -121.33 175.7 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 120.911 -1.118 . . . . 0.0 109.48 178.564 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -60.82 167.92 2.57 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.164 -0.96 . . . . 0.0 110.395 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.458 ' HD3' ' HD2' ' A' ' 43' ' ' PRO . 6.5 tpp180 -135.57 103.9 10.17 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.04 -1.038 . . . . 0.0 109.462 179.907 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.458 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 6.1 Cg_exo -57.26 137.84 83.51 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 C-N-CA 122.095 1.863 . . . . 0.0 110.229 179.657 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.528 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -79.56 6.94 9.22 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.428 -0.795 . . . . 0.0 111.013 -179.608 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.7 p -56.97 -20.32 23.1 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.979 -1.075 . . . . 0.0 110.392 179.252 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -82.55 -10.04 59.15 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.949 -1.095 . . . . 0.0 110.111 179.239 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.528 ' HG3' ' HB2' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -80.42 155.91 26.89 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.88 -1.138 . . . . 0.0 109.651 -179.971 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.426 ' HA ' ' HD2' ' A' ' 48' ' ' LYS . 5.5 mmmt -125.39 -156.86 0.75 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.216 -0.928 . . . . 0.0 109.489 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -51.25 -53.08 38.83 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.174 -0.954 . . . . 0.0 109.719 179.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -139.91 -168.32 11.29 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 179.533 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.424 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.1 mt -53.75 125.36 7.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.403 -1.057 . . . . 0.0 110.063 179.92 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -66.32 142.69 57.56 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.409 -0.807 . . . . 0.0 109.427 179.322 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.39 164.22 36.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.991 -1.068 . . . . 0.0 109.771 179.578 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.403 ' NH1' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -151.79 -165.44 2.23 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -179.59 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -54.27 116.27 2.52 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.052 -1.03 . . . . 0.0 108.712 179.107 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -45.05 135.64 5.29 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.585 -0.697 . . . . 0.0 110.607 -178.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt . . . . . 0 N--CA 1.497 1.898 0 O-C-N 121.43 -0.793 . . . . 0.0 109.915 -179.987 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 121.373 0.606 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.99 -40.37 2.54 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.239 -1.944 . . . . 0.0 108.239 -178.539 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.455 HG22 ' CE2' ' A' ' 18' ' ' TRP . 54.4 m -80.63 89.21 5.7 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.381 -1.07 . . . . 0.0 109.471 179.043 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.1 m -101.59 131.26 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 33.6 t -47.63 114.98 1.0 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.544 -0.722 . . . . 0.0 111.0 -179.122 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.1 m -59.69 -13.48 10.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.087 -1.008 . . . . 0.0 110.323 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -102.51 -32.06 10.12 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.822 -1.174 . . . . 0.0 110.931 -179.814 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.463 ' HB2' ' HA ' ' A' ' 44' ' ' LEU . 13.0 p -140.63 23.34 2.3 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.602 -1.312 . . . . 0.0 111.581 -179.532 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 38.75 29.45 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.495 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 178.675 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.495 ' HB ' ' HG3' ' A' ' 47' ' ' ARG . 15.3 t -86.69 132.7 33.8 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.669 -1.269 . . . . 0.0 109.403 178.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.4 p -89.31 -28.83 19.6 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.565 -0.709 . . . . 0.0 109.34 179.745 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.2 p -90.18 108.36 19.7 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.486 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 14.6 p -127.08 144.36 51.05 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.161 -0.962 . . . . 0.0 109.937 -179.527 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 30.9 p -65.96 -36.27 82.87 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.122 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.506 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -149.08 120.31 7.81 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.055 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.486 ' CZ2' HG23 ' A' ' 15' ' ' THR . 9.6 m95 -73.6 95.32 2.28 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.454 -0.779 . . . . 0.0 109.808 -179.452 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 77.11 2.3 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.403 -0.811 . . . . 0.0 108.82 179.629 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.426 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.5 mmt180 -61.19 95.3 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.454 -0.779 . . . . 0.0 109.059 -179.795 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.2 144.31 94.69 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.394 -0.816 . . . . 0.0 109.967 -179.162 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -58.69 -20.91 53.18 Favored 'Trans proline' 0 C--N 1.32 -0.973 0 C-N-CA 122.47 2.113 . . . . 0.0 110.672 179.85 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.8 0.04 25.31 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.18 -0.95 . . . . 0.0 109.9 178.978 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.66 32.57 15.15 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 109.433 -1.467 . . . . 0.0 109.433 -179.48 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -129.51 96.59 26.93 Favored Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 121.443 -1.034 . . . . 0.0 110.553 -179.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.498 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.6 Cg_endo -64.16 111.38 1.58 Allowed 'Trans proline' 0 C--N 1.314 -1.244 0 C-N-CA 122.223 1.949 . . . . 0.0 110.172 178.89 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.498 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -121.45 124.77 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.418 -0.801 . . . . 0.0 110.078 179.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.435 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 5.0 p -48.46 135.7 13.76 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.589 -0.694 . . . . 0.0 109.886 179.663 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.506 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 4.6 t-20 -37.04 -44.51 0.53 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.62 -0.675 . . . . 0.0 112.2 -178.608 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.66 -51.92 34.64 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.421 -0.8 . . . . 0.0 110.235 -179.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 63.6 m -63.63 -39.54 94.6 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.301 -0.875 . . . . 0.0 109.537 179.665 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.0 -36.13 91.8 Favored Glycine 0 N--CA 1.498 2.806 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 179.663 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.43 ' O ' HD11 ' A' ' 37' ' ' LEU . 85.7 mt -73.21 -66.55 0.67 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.395 -1.062 . . . . 0.0 109.985 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.605 ' CD1' ' HB2' ' A' ' 42' ' ' ARG . 8.3 t80 -49.11 -40.44 32.18 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.235 -0.916 . . . . 0.0 109.114 179.628 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.465 ' O ' ' N ' ' A' ' 39' ' ' GLN . 38.2 t80 -51.0 -48.63 61.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.633 -0.667 . . . . 0.0 109.405 179.486 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.39 -38.46 87.57 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.065 -1.022 . . . . 0.0 110.248 179.617 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 5.1 mp -41.08 -51.37 3.37 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.507 -0.745 . . . . 0.0 110.197 -179.577 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.527 ' HB2' ' CG2' ' A' ' 40' ' ' VAL . 4.1 m-70 -127.91 17.73 6.74 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.27 -0.893 . . . . 0.0 109.555 179.298 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.465 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.3 OUTLIER 47.22 46.77 16.66 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.817 0.817 . . . . 0.0 109.597 -178.989 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.527 ' CG2' ' HB2' ' A' ' 38' ' ' HIS . 3.8 m -133.6 164.36 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 O-C-N 121.41 -0.806 . . . . 0.0 109.963 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -77.97 163.06 26.3 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.431 -0.793 . . . . 0.0 110.351 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HB2' ' CD1' ' A' ' 34' ' ' TYR . 4.4 tpt180 -130.14 121.02 19.44 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.222 -0.924 . . . . 0.0 109.222 179.289 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.02 147.0 91.82 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 C-N-CA 121.925 1.75 . . . . 0.0 110.432 179.807 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.463 ' HA ' ' HB2' ' A' ' 10' ' ' CYS . 1.7 pt? -63.08 -10.99 16.62 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.442 -0.786 . . . . 0.0 110.921 179.588 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.9 t -48.73 -31.07 6.32 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.208 -0.933 . . . . 0.0 110.824 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.3 ttt -80.68 -39.66 26.83 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.162 -0.961 . . . . 0.0 109.426 179.656 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.495 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.8 OUTLIER -61.8 129.21 39.92 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.111 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.16 -149.56 0.36 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.281 -0.887 . . . . 0.0 109.685 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -50.63 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.433 -0.792 . . . . 0.0 110.899 -179.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.02 -168.45 13.1 Favored Glycine 0 N--CA 1.495 2.587 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 -179.752 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 13.9 mt -48.05 129.53 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.606 -0.938 . . . . 0.0 110.455 -179.772 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -76.36 78.68 3.11 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.3 -0.875 . . . . 0.0 109.861 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.47 161.15 26.25 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.401 -0.812 . . . . 0.0 109.638 179.591 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.418 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.4 OUTLIER -150.77 -153.63 0.5 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.61 -0.681 . . . . 0.0 109.767 -179.501 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -74.97 128.94 36.75 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.06 -1.025 . . . . 0.0 108.724 179.031 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.59 133.64 10.1 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.586 -0.696 . . . . 0.0 110.643 -179.349 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt . . . . . 0 N--CA 1.497 1.883 0 O-C-N 121.366 -0.834 . . . . 0.0 109.497 179.801 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.53 -33.54 3.58 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 -179.058 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.476 HG23 ' CD2' ' A' ' 18' ' ' TRP . 27.2 m -62.77 90.75 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.32 -1.106 . . . . 0.0 108.787 178.95 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . 0.404 HG21 ' O ' ' A' ' 6' ' ' VAL . 9.5 m -84.96 112.66 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.069 -1.019 . . . . 0.0 108.379 -179.975 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.505 ' O ' ' N ' ' A' ' 11' ' ' GLN . 44.8 t -47.45 113.7 0.74 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.428 -0.795 . . . . 0.0 109.917 -179.157 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 62.0 m -66.68 -12.56 58.86 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.021 -1.049 . . . . 0.0 111.001 -179.247 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.405 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.9 OUTLIER -89.62 -31.31 17.61 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.84 -1.162 . . . . 0.0 110.228 179.879 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.441 ' SG ' ' CG2' ' A' ' 12' ' ' THR . 16.8 p -140.46 17.4 2.38 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.887 -1.133 . . . . 0.0 111.057 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 7' ' ' CYS . 11.5 mt-30 51.49 21.2 1.19 Allowed 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.989 -1.069 . . . . 0.0 111.801 178.949 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.441 ' CG2' ' SG ' ' A' ' 10' ' ' CYS . 6.3 t -87.61 136.47 32.93 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.681 -1.262 . . . . 0.0 110.564 -179.724 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -27.12 18.93 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.302 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.472 HG21 ' HA2' ' A' ' 50' ' ' GLY . 18.6 p -90.06 127.09 35.99 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.416 -0.802 . . . . 0.0 109.537 179.527 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.587 HG23 ' CZ3' ' A' ' 18' ' ' TRP . 10.3 p -145.69 144.09 30.18 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.409 -0.807 . . . . 0.0 110.225 -179.558 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 20.2 p -72.63 -28.59 62.85 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.329 -0.857 . . . . 0.0 109.098 179.139 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -152.71 117.17 4.98 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.173 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.587 ' CZ3' HG23 ' A' ' 15' ' ' THR . 8.0 m95 -73.82 108.81 6.87 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.183 -0.948 . . . . 0.0 110.09 -179.02 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -99.3 94.47 6.48 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.133 -0.979 . . . . 0.0 109.452 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.432 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.3 tpp180 -66.6 102.71 0.95 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 108.364 179.364 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -56.36 146.74 51.62 Favored Pre-proline 0 N--CA 1.5 2.052 0 O-C-N 121.388 -0.82 . . . . 0.0 110.209 -178.718 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -52.92 -43.91 52.82 Favored 'Trans proline' 0 C--N 1.319 -0.995 0 C-N-CA 122.702 2.268 . . . . 0.0 111.07 -179.05 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.6 ttp -57.59 -23.49 51.11 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.414 -0.804 . . . . 0.0 109.717 179.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.35 38.22 1.38 Allowed Glycine 0 N--CA 1.496 2.665 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 21' ' ' SER . 60.5 m-20 -128.3 110.09 19.54 Favored Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.1 -1.236 . . . . 0.0 110.491 -179.841 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.468 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 3.5 Cg_exo -62.92 109.86 1.01 Allowed 'Trans proline' 0 C--N 1.313 -1.313 0 C-N-CA 122.011 1.807 . . . . 0.0 110.062 178.627 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.422 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.1 m -121.56 131.38 73.21 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.163 -0.961 . . . . 0.0 110.407 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.471 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.8 p -55.03 132.55 47.4 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.663 -0.648 . . . . 0.0 109.305 179.556 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 16.7 t-20 -35.58 -46.09 0.39 Allowed 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.87 -0.519 . . . . 0.0 112.162 -178.313 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.77 -45.46 59.0 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.347 -0.845 . . . . 0.0 110.206 -179.688 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 19.4 m -65.53 -39.34 91.68 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.177 -0.952 . . . . 0.0 109.001 179.263 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.22 -43.39 95.45 Favored Glycine 0 N--CA 1.497 2.743 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.492 HD12 ' OD1' ' A' ' 29' ' ' ASN . 46.6 mt -75.69 -57.46 3.87 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.454 -1.027 . . . . 0.0 109.698 -179.831 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.54 ' CE2' ' HG3' ' A' ' 42' ' ' ARG . 26.9 t80 -51.84 -38.56 56.39 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.512 -0.742 . . . . 0.0 109.046 179.475 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.478 ' O ' ' N ' ' A' ' 39' ' ' GLN . 44.8 t80 -56.35 -45.56 80.38 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 178.705 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.04 -39.4 93.29 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.066 -1.021 . . . . 0.0 109.899 179.319 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.449 HD12 ' O ' ' A' ' 33' ' ' LEU . 5.8 mp -44.88 -59.12 2.71 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.562 -0.711 . . . . 0.0 110.128 -179.466 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.461 ' CB ' HG21 ' A' ' 40' ' ' VAL . 87.9 m-70 -104.14 4.64 34.34 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.45 -0.781 . . . . 0.0 109.415 178.828 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 49.7 33.83 6.62 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.565 -0.709 . . . . 0.0 110.027 -178.702 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.461 HG21 ' CB ' ' A' ' 38' ' ' HIS . 11.1 m -140.17 163.79 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 O-C-N 121.463 -0.773 . . . . 0.0 110.018 -179.612 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -82.17 140.97 33.44 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.335 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.54 ' HG3' ' CE2' ' A' ' 34' ' ' TYR . 2.3 mmm180 -127.99 150.39 73.5 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.014 -1.054 . . . . 0.0 110.09 -179.493 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -57.09 151.68 49.07 Favored 'Trans proline' 0 C--N 1.315 -1.211 0 C-N-CA 123.005 2.47 . . . . 0.0 111.814 -179.074 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.427 ' HB2' ' HD3' ' A' ' 47' ' ' ARG . 1.0 OUTLIER -71.57 10.18 0.7 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.594 -0.691 . . . . 0.0 111.568 179.793 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.02 -32.41 61.82 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.611 -1.305 . . . . 0.0 110.18 179.54 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.07 -12.78 49.24 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.399 -0.813 . . . . 0.0 110.346 179.515 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.427 ' HD3' ' HB2' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -58.71 162.11 4.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.903 -1.123 . . . . 0.0 109.965 179.822 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.28 149.76 46.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.458 -0.776 . . . . 0.0 109.456 178.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -63.81 -35.01 79.21 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.493 -0.754 . . . . 0.0 110.175 -179.862 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . 0.472 ' HA2' HG21 ' A' ' 14' ' ' THR . . . -134.53 157.0 22.73 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 179.318 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.465 HD13 HG22 ' A' ' 51' ' ' ILE . 4.9 mt -53.31 119.5 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.157 -1.202 . . . . 0.0 109.987 -179.618 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.461 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -75.6 167.28 22.19 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.634 -0.666 . . . . 0.0 109.206 179.755 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.461 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -154.98 160.67 41.27 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.571 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.47 -161.66 1.39 Allowed 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -179.617 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.37 94.46 0.06 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.825 -1.172 . . . . 0.0 108.924 179.302 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -54.49 143.84 22.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.483 -0.761 . . . . 0.0 109.97 -179.502 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp . . . . . 0 N--CA 1.493 1.716 0 O-C-N 121.358 -0.839 . . . . 0.0 109.152 179.797 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.239 0.542 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.91 -18.23 12.68 Favored Glycine 0 N--CA 1.495 2.596 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.461 HG21 ' CH2' ' A' ' 18' ' ' TRP . 15.2 m -76.46 85.57 3.19 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.82 -1.4 . . . . 0.0 110.314 -179.789 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 m -85.77 120.37 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 178.18 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.484 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 51.5 t -45.46 111.55 0.35 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.206 -0.934 . . . . 0.0 110.202 -178.327 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 71.8 m -59.71 -14.31 13.64 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.171 -0.956 . . . . 0.0 111.437 -179.212 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.545 ' OD1' ' HD2' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -95.39 -30.83 13.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.634 -1.291 . . . . 0.0 110.734 -179.572 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.483 ' SG ' ' HD3' ' A' ' 47' ' ' ARG . 18.4 p -141.26 28.37 1.87 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.897 -1.127 . . . . 0.0 110.492 179.289 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.46 ' N ' ' O ' ' A' ' 7' ' ' CYS . 5.5 pm0 34.22 30.19 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.728 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 179.781 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.424 ' N ' ' O ' ' A' ' 10' ' ' CYS . 5.1 t -90.88 132.56 35.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.747 -1.22 . . . . 0.0 109.844 179.479 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.2 p -90.29 -28.6 18.67 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.237 -0.914 . . . . 0.0 109.107 179.379 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.7 p -89.86 111.04 21.95 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.431 -0.793 . . . . 0.0 109.479 179.5 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.487 HG21 ' CZ2' ' A' ' 18' ' ' TRP . 9.5 p -130.97 166.52 20.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.332 -0.855 . . . . 0.0 110.205 -179.712 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 16.2 p -89.41 -40.57 12.63 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.353 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.505 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 14.3 mt -141.89 112.56 7.22 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.321 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.487 ' CZ2' HG21 ' A' ' 15' ' ' THR . 7.0 m95 -69.67 88.72 0.53 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.304 -0.873 . . . . 0.0 109.608 -179.389 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.78 84.85 7.2 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.61 -0.682 . . . . 0.0 109.424 -179.913 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.452 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 9.3 tpp180 -62.17 120.83 11.67 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.113 -0.992 . . . . 0.0 109.213 179.726 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.59 144.01 68.84 Favored Pre-proline 0 N--CA 1.498 1.932 0 O-C-N 121.298 -0.876 . . . . 0.0 110.187 -179.439 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -56.45 -42.49 65.09 Favored 'Trans proline' 0 C--N 1.319 -1.014 0 C-N-CA 122.737 2.291 . . . . 0.0 111.197 -179.294 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -21.03 39.62 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.299 -0.875 . . . . 0.0 110.061 179.486 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.63 35.92 1.65 Allowed Glycine 0 N--CA 1.497 2.759 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -127.03 102.75 24.13 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.207 -1.172 . . . . 0.0 110.142 -179.796 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.463 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.6 Cg_endo -64.02 98.56 0.26 Allowed 'Trans proline' 0 C--N 1.312 -1.364 0 C-N-CA 122.162 1.908 . . . . 0.0 109.604 178.793 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.484 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.0 m -109.74 153.94 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 CA-C-O 122.348 1.07 . . . . 0.0 111.114 -179.622 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.443 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 15.3 p -81.48 138.72 35.47 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.433 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.505 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 4.7 t-20 -37.96 -37.24 0.24 Allowed 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.695 -0.628 . . . . 0.0 111.971 -178.799 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.39 -42.77 95.94 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.09 -1.006 . . . . 0.0 111.695 -179.329 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 4.9 m -61.52 -40.67 95.47 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.212 -0.93 . . . . 0.0 109.088 -179.934 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.4 -49.02 54.53 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.432 ' O ' HD12 ' A' ' 37' ' ' LEU . 94.8 mt -60.58 -58.41 8.6 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.638 -0.919 . . . . 0.0 109.63 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.592 ' CE1' ' HD2' ' A' ' 43' ' ' PRO . 20.4 t80 -54.51 -43.84 72.21 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.543 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.507 ' CD2' ' O ' ' A' ' 40' ' ' VAL . 20.0 t80 -51.91 -46.57 64.66 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.508 -0.745 . . . . 0.0 109.073 179.27 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -63.34 -41.92 98.9 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.214 -0.929 . . . . 0.0 110.152 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.432 HD12 ' O ' ' A' ' 33' ' ' LEU . 3.9 mp -45.36 -59.28 2.76 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.329 -0.857 . . . . 0.0 110.427 -179.439 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.407 ' HB2' ' CG2' ' A' ' 40' ' ' VAL . 53.4 m-70 -102.61 6.42 39.71 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.374 -0.829 . . . . 0.0 109.853 179.565 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.448 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.6 OUTLIER 46.7 31.89 1.55 Allowed 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.51 -0.744 . . . . 0.0 110.299 -179.212 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.507 ' O ' ' CD2' ' A' ' 35' ' ' TYR . 3.9 m -134.61 -161.47 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 O-C-N 121.476 -0.765 . . . . 0.0 109.048 179.652 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -59.1 -175.01 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.996 -1.065 . . . . 0.0 110.596 -179.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.545 ' HD2' ' OD1' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -141.1 102.91 6.17 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.106 -0.996 . . . . 0.0 109.969 -179.189 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.592 ' HD2' ' CE1' ' A' ' 34' ' ' TYR . 3.9 Cg_exo -60.62 126.05 18.87 Favored 'Trans proline' 0 C--N 1.315 -1.186 0 C-N-CA 121.991 1.794 . . . . 0.0 110.08 179.753 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pp -85.05 16.43 3.47 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.385 -0.822 . . . . 0.0 110.935 -179.836 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 p -68.45 -5.65 20.46 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.02 -1.05 . . . . 0.0 111.07 -179.917 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.9 mtp -94.23 -26.79 16.49 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.883 -1.136 . . . . 0.0 110.144 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.483 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -65.25 154.4 38.25 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.215 -0.928 . . . . 0.0 110.264 179.994 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.36 -158.61 0.9 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.921 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.08 -39.1 84.9 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.288 -0.882 . . . . 0.0 109.693 179.384 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.07 -175.33 14.13 Favored Glycine 0 N--CA 1.5 2.931 0 N-CA-C 110.19 -1.164 . . . . 0.0 110.19 179.513 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.8 mt -62.31 137.12 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.286 -1.126 . . . . 0.0 108.965 179.453 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.66 79.87 0.07 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.22 -0.925 . . . . 0.0 111.047 -178.638 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.06 159.54 15.43 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.137 -0.977 . . . . 0.0 110.4 179.564 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.64 -159.11 0.99 Allowed 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -52.56 103.15 0.06 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.833 -1.167 . . . . 0.0 109.159 179.208 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.5 ttm180 -50.74 140.8 14.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.369 -0.832 . . . . 0.0 110.339 -178.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.475 -0.766 . . . . 0.0 109.281 179.077 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.79 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.25 -26.52 5.51 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.452 HG21 ' CB ' ' A' ' 26' ' ' PRO . 70.8 m -68.4 92.64 0.44 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.302 -1.117 . . . . 0.0 109.089 179.295 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -90.91 138.26 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.283 -0.886 . . . . 0.0 108.722 179.839 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.652 ' HB2' HG22 ' A' ' 12' ' ' THR . 24.6 t -62.42 118.08 7.02 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.146 -0.971 . . . . 0.0 110.973 -179.35 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 m -60.4 -15.47 26.52 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.387 -0.821 . . . . 0.0 110.295 178.85 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -102.82 -30.4 10.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.065 -1.022 . . . . 0.0 110.852 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.489 ' SG ' ' HG3' ' A' ' 47' ' ' ARG . 12.8 p -142.66 23.43 1.94 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.672 -1.268 . . . . 0.0 111.909 -179.306 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 38.25 37.5 0.16 Allowed 'General case' 0 N--CA 1.511 2.597 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 178.483 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.652 HG22 ' HB2' ' A' ' 7' ' ' CYS . 5.3 t -88.14 135.13 33.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.527 -1.358 . . . . 0.0 108.694 178.333 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.4 p -90.44 -10.79 42.45 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.159 -0.963 . . . . 0.0 109.736 179.922 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.7 p -121.26 132.53 54.86 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.217 -0.927 . . . . 0.0 108.697 178.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.58 HG23 HG21 ' A' ' 12' ' ' THR . 6.5 p -145.74 157.18 43.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.411 -0.806 . . . . 0.0 109.668 -179.811 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.4 p -77.93 -35.63 50.24 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.281 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.475 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.6 mt -146.53 106.58 4.0 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.599 -0.688 . . . . 0.0 109.486 179.638 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -65.3 111.69 3.13 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.555 -0.715 . . . . 0.0 110.497 -179.372 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.29 72.07 5.3 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.242 -0.911 . . . . 0.0 109.126 179.276 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.9 OUTLIER -61.98 110.49 1.58 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.204 -0.935 . . . . 0.0 109.277 -179.965 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.2 154.2 86.3 Favored Pre-proline 0 N--CA 1.497 1.905 0 O-C-N 121.298 -0.876 . . . . 0.0 110.036 -179.705 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -53.39 -48.14 23.57 Favored 'Trans proline' 0 C--N 1.319 -1.017 0 C-N-CA 122.762 2.308 . . . . 0.0 111.407 -178.943 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.0 -21.58 59.21 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.341 -0.849 . . . . 0.0 110.05 179.503 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.44 50.59 0.65 Allowed Glycine 0 N--CA 1.496 2.689 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 -179.81 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -127.46 89.58 50.91 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.574 -0.956 . . . . 0.0 109.994 -179.377 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.509 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 1.4 Cg_endo -66.4 94.51 0.31 Allowed 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 122.299 1.999 . . . . 0.0 110.0 179.434 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.484 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -109.69 125.86 66.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.06 -1.025 . . . . 0.0 110.52 -179.833 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.548 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 5.2 p -49.98 134.26 21.69 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.674 -0.641 . . . . 0.0 110.07 179.786 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.475 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 1.7 t-20 -36.77 -47.74 0.69 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.876 -0.515 . . . . 0.0 111.519 -178.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.39 -46.2 25.86 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.43 -0.794 . . . . 0.0 110.578 -179.66 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 27.0 m -66.34 -43.8 85.08 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.21 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.51 -32.17 68.27 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 110.114 -1.194 . . . . 0.0 110.114 179.069 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 61.0 mt -79.53 -62.29 1.74 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.334 -1.098 . . . . 0.0 109.844 179.905 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -50.99 -36.73 40.72 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.292 -0.88 . . . . 0.0 108.79 179.346 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.512 ' O ' ' N ' ' A' ' 39' ' ' GLN . 31.0 t80 -61.88 -46.49 89.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.45 -0.781 . . . . 0.0 109.712 179.298 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -22.03 57.96 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.259 -1.525 . . . . 0.0 110.079 179.457 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.475 HD12 ' N ' ' A' ' 37' ' ' LEU . 8.1 mp -74.54 -71.82 0.32 Allowed 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.976 -1.078 . . . . 0.0 109.851 179.836 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 51.7 m-70 -93.95 -18.81 21.53 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.309 -0.869 . . . . 0.0 110.477 -179.901 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.512 ' N ' ' O ' ' A' ' 35' ' ' TYR . 2.3 tt0 61.54 53.36 3.36 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-O 122.192 0.996 . . . . 0.0 109.951 -179.897 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.6 m -138.51 168.08 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.185 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -70.24 126.15 28.83 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.813 -1.179 . . . . 0.0 109.337 179.917 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.414 ' CD ' ' HD2' ' A' ' 43' ' ' PRO . 5.4 tpt180 -96.62 110.53 53.53 Favored Pre-proline 0 N--CA 1.493 1.706 0 O-C-N 121.205 -0.934 . . . . 0.0 109.735 -179.444 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.414 ' HD2' ' CD ' ' A' ' 42' ' ' ARG . 6.2 Cg_exo -56.15 147.21 66.63 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 C-N-CA 121.976 1.784 . . . . 0.0 110.408 179.272 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.27 7.73 1.22 Allowed 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.429 -0.794 . . . . 0.0 111.615 -179.795 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -50.25 -30.68 12.26 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.905 -1.122 . . . . 0.0 109.933 179.232 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.0 ttp -103.56 -24.13 13.44 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.342 -0.849 . . . . 0.0 110.227 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.489 ' HG3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -59.22 143.52 48.81 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.152 -0.967 . . . . 0.0 109.92 -179.858 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.439 ' HB2' ' OE1' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -123.39 157.21 33.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.261 -0.899 . . . . 0.0 109.709 179.587 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -71.37 -29.71 65.28 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.599 -0.688 . . . . 0.0 110.323 -179.596 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -111.71 132.6 10.95 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 179.548 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.9 mt -51.04 125.11 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.724 -0.868 . . . . 0.0 110.63 -179.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.439 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -73.72 157.17 37.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.609 -0.682 . . . . 0.0 109.61 179.24 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.06 164.15 38.25 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.01 -1.056 . . . . 0.0 109.825 179.201 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.92 -158.79 0.95 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.587 -0.696 . . . . 0.0 109.383 -179.677 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -55.83 98.47 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.899 -1.126 . . . . 0.0 108.961 179.215 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -49.99 139.74 13.38 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.499 -0.751 . . . . 0.0 110.818 -178.602 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 O-C-N 121.584 -0.698 . . . . 0.0 109.432 179.455 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.95 -11.23 6.96 Favored Glycine 0 N--CA 1.497 2.726 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 -179.192 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.458 HG21 ' CD2' ' A' ' 18' ' ' TRP . 93.9 m -65.45 88.53 0.09 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.071 -1.253 . . . . 0.0 109.626 179.702 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.9 m -88.53 112.08 23.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 179.16 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.563 ' CB ' HG21 ' A' ' 12' ' ' THR . 52.7 t -46.88 113.36 0.65 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.277 -0.889 . . . . 0.0 110.071 -178.486 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.1 m -61.17 -14.81 27.82 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.359 -0.838 . . . . 0.0 111.073 -179.484 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.427 ' CB ' ' SG ' ' A' ' 31' ' ' CYS . 12.1 m-20 -94.76 -30.09 14.43 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.863 -1.148 . . . . 0.0 110.988 -179.485 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.579 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 18.5 p -139.66 19.84 2.52 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.56 -1.338 . . . . 0.0 111.383 179.598 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 7' ' ' CYS . 3.9 mt-30 45.81 26.17 0.35 Allowed 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.233 -0.917 . . . . 0.0 111.97 179.014 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.563 HG21 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -84.94 136.7 33.51 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.709 -1.244 . . . . 0.0 109.977 179.684 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 p -93.48 1.54 56.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.565 -0.71 . . . . 0.0 109.427 178.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.449 ' HB ' HG13 ' A' ' 51' ' ' ILE . 79.2 p -127.42 130.9 50.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.047 -1.033 . . . . 0.0 110.111 -179.606 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.526 HG22 ' CZ3' ' A' ' 18' ' ' TRP . 9.3 p -147.89 143.03 27.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.443 -0.786 . . . . 0.0 109.771 179.625 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 44.6 p -72.12 -33.57 67.91 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 178.791 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 69.3 mt -142.39 105.54 4.59 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.067 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.526 ' CZ3' HG22 ' A' ' 15' ' ' THR . 12.5 m95 -64.77 86.34 0.05 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.418 -0.802 . . . . 0.0 109.656 -179.877 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.33 81.39 0.37 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 109.73 -179.795 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.481 ' HD3' ' CA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.96 101.45 0.21 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.073 -1.017 . . . . 0.0 108.766 179.517 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.93 141.72 47.45 Favored Pre-proline 0 N--CA 1.497 1.894 0 O-C-N 121.411 -0.806 . . . . 0.0 109.997 -179.034 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -53.88 -36.21 82.44 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 122.504 2.136 . . . . 0.0 110.962 -179.318 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' MET . . . . . 0.442 ' HA ' ' CE ' ' A' ' 23' ' ' MET . 1.1 tpt -60.03 -22.21 62.35 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.365 -0.834 . . . . 0.0 109.871 179.318 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.92 33.25 2.05 Favored Glycine 0 N--CA 1.497 2.722 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.659 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -126.09 113.0 24.07 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.172 -1.193 . . . . 0.0 110.42 -179.557 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.481 ' CA ' ' HD3' ' A' ' 20' ' ' ARG . 3.2 Cg_exo -64.1 100.1 0.3 Allowed 'Trans proline' 0 C--N 1.316 -1.174 0 C-N-CA 122.313 2.009 . . . . 0.0 110.083 178.879 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.501 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -119.88 127.17 75.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.126 -0.984 . . . . 0.0 110.149 179.947 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.478 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 8.3 p -51.43 136.54 25.44 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.479 -0.763 . . . . 0.0 109.397 179.331 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -43.36 -43.42 5.08 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.418 -0.801 . . . . 0.0 111.611 -178.252 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.34 -44.38 34.27 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.255 -0.903 . . . . 0.0 110.287 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.427 ' SG ' ' CB ' ' A' ' 9' ' ' ASN . 5.4 m -63.69 -43.67 95.94 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.342 -0.849 . . . . 0.0 109.229 179.235 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.4 -57.18 15.97 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 110.35 -1.1 . . . . 0.0 110.35 -179.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . 0.488 ' O ' HD13 ' A' ' 37' ' ' LEU . 16.9 mt -60.77 -55.79 28.97 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.452 -1.028 . . . . 0.0 109.357 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.45 ' OH ' ' HG3' ' A' ' 42' ' ' ARG . 75.0 t80 -49.95 -43.88 50.23 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.613 -0.68 . . . . 0.0 109.597 179.498 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -56.17 -45.93 79.53 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.301 -0.874 . . . . 0.0 109.285 179.388 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.36 -30.94 71.54 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.095 -1.003 . . . . 0.0 110.142 179.435 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.488 HD13 ' O ' ' A' ' 33' ' ' LEU . 4.7 mp -61.73 -65.62 0.66 Allowed 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.098 -1.001 . . . . 0.0 110.625 -179.608 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.423 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 59.8 m-70 -95.59 9.32 40.61 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.221 -0.924 . . . . 0.0 110.532 -179.66 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER 41.08 32.51 0.18 Allowed 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.519 -0.738 . . . . 0.0 111.424 -179.182 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.5 m -145.57 169.77 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 121.281 -0.887 . . . . 0.0 109.807 179.759 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -85.85 154.23 21.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.262 -0.898 . . . . 0.0 109.368 178.899 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.45 ' HG3' ' OH ' ' A' ' 34' ' ' TYR . 30.0 mmt180 -149.98 151.18 31.69 Favored Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 121.061 -1.024 . . . . 0.0 109.77 179.519 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -59.33 147.51 90.7 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 C-N-CA 122.205 1.936 . . . . 0.0 110.785 179.961 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.579 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -89.73 37.64 0.88 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.123 -0.986 . . . . 0.0 110.806 -179.781 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.0 p -70.59 -11.28 60.84 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.011 -1.055 . . . . 0.0 109.971 178.894 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 1.4 tmm? -88.1 -18.55 28.6 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.236 -0.915 . . . . 0.0 110.445 179.64 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.489 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -57.24 139.01 53.98 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.89 -1.131 . . . . 0.0 110.036 -179.889 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -99.49 -177.57 3.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.387 -0.821 . . . . 0.0 109.493 -179.981 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -64.04 -37.5 87.66 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.253 -0.904 . . . . 0.0 110.032 -179.811 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -142.8 171.21 24.92 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.637 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.449 HG13 ' HB ' ' A' ' 14' ' ' THR . 14.5 mt -54.44 121.87 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.381 -1.07 . . . . 0.0 109.861 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.35 146.83 52.9 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.39 -0.819 . . . . 0.0 108.822 179.182 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.38 157.59 41.5 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.297 -0.877 . . . . 0.0 109.763 179.278 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.413 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -152.44 -168.71 3.13 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 -179.904 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -61.8 105.5 0.56 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.885 -1.134 . . . . 0.0 108.279 179.012 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -45.25 135.37 5.86 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.286 -0.884 . . . . 0.0 110.048 -178.583 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.511 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.814 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 109.03 -30.34 8.77 Favored Glycine 0 N--CA 1.498 2.825 0 N-CA-C 109.531 -1.427 . . . . 0.0 109.531 -179.348 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.543 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 16.2 m -78.62 90.24 4.55 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.128 -1.219 . . . . 0.0 109.579 179.654 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.9 m -81.93 116.13 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 179.175 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.485 ' CB ' HG23 ' A' ' 12' ' ' THR . 41.3 t -49.1 113.87 0.89 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.203 -0.935 . . . . 0.0 110.11 -178.61 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -60.11 -15.29 22.23 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.635 -0.666 . . . . 0.0 111.141 -179.497 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -96.69 -30.64 13.11 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.911 -1.118 . . . . 0.0 111.376 -179.051 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.516 ' HB2' ' HA ' ' A' ' 44' ' ' LEU . 15.6 p -140.49 26.16 2.16 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.698 -1.251 . . . . 0.0 111.189 179.939 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 40.56 27.88 0.04 OUTLIER 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.161 -0.962 . . . . 0.0 112.627 178.422 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.485 HG23 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -89.59 136.78 32.83 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.569 -1.332 . . . . 0.0 110.081 179.925 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.0 p -92.22 -30.42 15.92 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.493 -0.754 . . . . 0.0 109.033 179.168 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.5 p -92.45 125.32 37.05 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.364 -0.835 . . . . 0.0 109.601 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.573 HG23 ' CZ3' ' A' ' 18' ' ' TRP . 16.4 p -143.3 148.94 37.12 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.165 -0.96 . . . . 0.0 110.814 179.961 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 70.6 p -73.87 -33.92 64.25 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.956 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.404 ' O ' ' HB2' ' A' ' 29' ' ' ASN . 15.6 mt -150.87 105.45 3.27 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.405 -0.81 . . . . 0.0 108.92 179.536 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.573 ' CZ3' HG23 ' A' ' 15' ' ' THR . 7.0 m95 -63.49 84.22 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.421 -0.799 . . . . 0.0 110.936 -178.856 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.43 77.51 7.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.08 -1.012 . . . . 0.0 109.194 179.36 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.576 ' CB ' ' HA ' ' A' ' 26' ' ' PRO . 5.2 ppt_? -80.0 138.62 37.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.022 -1.049 . . . . 0.0 110.033 -179.56 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -86.89 148.27 45.2 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.255 -0.903 . . . . 0.0 109.944 -179.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -55.0 -31.3 73.85 Favored 'Trans proline' 0 C--N 1.319 -1.026 0 C-N-CA 122.522 2.148 . . . . 0.0 111.024 -179.7 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.04 -28.56 53.12 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.409 -0.807 . . . . 0.0 109.803 179.195 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 117.09 34.52 1.22 Allowed Glycine 0 N--CA 1.497 2.713 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 179.678 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -130.88 96.03 24.02 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.281 -1.129 . . . . 0.0 109.911 -179.794 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.576 ' HA ' ' CB ' ' A' ' 20' ' ' ARG . 2.3 Cg_endo -65.17 106.21 0.79 Allowed 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 122.465 2.11 . . . . 0.0 110.31 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.456 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -119.1 129.27 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.071 -1.018 . . . . 0.0 110.428 -179.985 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.451 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 6.6 p -52.33 133.57 34.55 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 121.387 -0.82 . . . . 0.0 109.42 179.468 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 18.9 t-20 -34.34 -49.73 0.39 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.724 -0.61 . . . . 0.0 112.203 -178.445 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -46.82 -49.05 20.65 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.383 -0.823 . . . . 0.0 110.767 -179.424 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.473 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 27.1 m -62.56 -45.46 92.83 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.383 -0.823 . . . . 0.0 109.096 179.533 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.21 -30.59 64.4 Favored Glycine 0 N--CA 1.494 2.553 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 179.832 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.6 mt -80.34 -63.12 1.48 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.391 -1.064 . . . . 0.0 109.8 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -52.59 -35.17 53.67 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.32 -0.862 . . . . 0.0 109.174 179.635 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.578 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 8.5 t80 -66.37 -52.81 42.99 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.515 -0.74 . . . . 0.0 110.232 179.493 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -54.84 -28.42 49.68 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.135 -1.603 . . . . 0.0 109.985 -179.992 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mp -72.67 -64.37 0.97 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.083 -1.011 . . . . 0.0 110.662 -179.988 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.439 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 15.1 m-70 -96.87 -28.01 14.42 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.141 -0.974 . . . . 0.0 110.653 -179.198 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.578 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.2 OUTLIER 76.08 26.53 0.98 Allowed 'General case' 0 N--CA 1.503 2.191 0 CA-C-O 121.599 0.714 . . . . 0.0 111.039 -179.929 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.0 m -113.91 166.93 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.035 -1.041 . . . . 0.0 109.848 178.63 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.8 p-10 -84.82 130.48 34.66 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.149 -0.969 . . . . 0.0 110.097 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -105.98 137.38 19.35 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.381 -0.825 . . . . 0.0 109.96 -179.554 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -63.57 145.53 91.85 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 122.237 1.958 . . . . 0.0 110.224 179.204 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.516 ' HA ' ' HB2' ' A' ' 10' ' ' CYS . 1.7 pp -72.54 -4.23 29.35 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.206 -0.933 . . . . 0.0 110.943 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.64 -26.59 22.92 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.068 -1.02 . . . . 0.0 110.261 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -65.94 -26.37 67.56 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.899 -1.125 . . . . 0.0 109.685 179.17 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.02 165.68 24.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.182 -0.949 . . . . 0.0 109.687 179.475 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -127.96 -166.18 1.58 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.182 -0.949 . . . . 0.0 109.332 -179.938 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -46.83 -64.73 0.7 Allowed 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.315 -0.866 . . . . 0.0 109.958 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -117.74 -177.13 17.33 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.344 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.3 mt -54.43 128.65 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.144 -1.21 . . . . 0.0 109.912 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.61 144.21 51.25 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.448 -0.782 . . . . 0.0 110.088 -179.933 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.16 160.92 41.28 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.373 -0.83 . . . . 0.0 109.549 178.959 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.67 -158.27 0.89 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.62 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -58.16 114.97 2.63 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.908 -1.12 . . . . 0.0 108.499 179.233 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.1 ttp180 -47.17 141.02 4.71 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.567 -0.708 . . . . 0.0 111.007 -178.622 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.801 0 O-C-N 121.585 -0.697 . . . . 0.0 109.74 179.754 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.733 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.2 -12.49 7.16 Favored Glycine 0 N--CA 1.495 2.604 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 -179.333 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.507 HG21 ' CB ' ' A' ' 26' ' ' PRO . 17.4 m -54.4 100.58 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.025 -1.279 . . . . 0.0 108.942 179.188 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.7 m -87.03 137.37 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 120.987 -1.071 . . . . 0.0 108.981 -179.454 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.541 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 31.9 t -67.02 117.57 9.26 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.335 -0.853 . . . . 0.0 110.583 -179.257 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.8 m -63.05 -7.61 5.8 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.381 -0.824 . . . . 0.0 110.545 178.913 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.452 ' ND2' HG11 ' A' ' 27' ' ' VAL . 1.2 m-80 -109.82 -28.14 8.94 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.93 -1.106 . . . . 0.0 111.177 -179.389 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.512 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 14.6 p -142.5 17.22 2.03 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 120.501 -1.375 . . . . 0.0 111.59 -179.813 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 47.64 26.3 0.82 Allowed 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.21 -0.931 . . . . 0.0 112.116 178.576 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.437 HG23 ' HB2' ' A' ' 7' ' ' CYS . 3.3 t -90.11 128.7 36.38 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.582 -1.324 . . . . 0.0 109.521 179.147 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.48 -27.99 19.97 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.849 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -88.8 106.59 18.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.483 -0.761 . . . . 0.0 109.562 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.524 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 17.8 p -128.34 157.05 42.05 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.449 -0.782 . . . . 0.0 110.212 -179.69 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' THR . . . . . 0.438 ' CG2' ' CG2' ' A' ' 51' ' ' ILE . 40.8 p -86.31 -39.68 16.25 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.946 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.585 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 23.3 mt -138.04 102.27 4.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.435 -0.79 . . . . 0.0 109.417 179.638 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.524 ' CZ2' HG23 ' A' ' 15' ' ' THR . 5.7 m95 -62.9 106.76 0.86 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.39 -0.819 . . . . 0.0 110.148 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -97.42 73.87 2.44 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.445 -0.785 . . . . 0.0 109.384 179.828 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.475 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -67.04 112.37 4.35 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.224 -0.922 . . . . 0.0 109.124 179.898 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.04 150.99 97.41 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.178 -0.951 . . . . 0.0 109.434 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -52.81 -41.06 72.69 Favored 'Trans proline' 0 C--N 1.317 -1.091 0 C-N-CA 122.486 2.124 . . . . 0.0 111.186 -179.147 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -25.29 50.22 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.264 -0.897 . . . . 0.0 110.06 179.331 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.5 44.43 0.84 Allowed Glycine 0 N--CA 1.497 2.746 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 179.767 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -128.08 98.74 26.3 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.326 -1.103 . . . . 0.0 110.46 -179.652 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.517 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.0 Cg_endo -66.5 94.91 0.32 Allowed 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.372 2.048 . . . . 0.0 109.998 178.811 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.541 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -114.08 123.71 70.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 120.961 -1.087 . . . . 0.0 110.406 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.6 p -48.42 132.8 16.67 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.64 -0.663 . . . . 0.0 109.379 179.338 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.585 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t-20 -40.44 -40.98 1.31 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.658 -0.652 . . . . 0.0 111.568 -177.943 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.58 -43.98 56.7 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.96 -1.088 . . . . 0.0 110.478 179.773 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.402 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 13.3 m -65.73 -39.2 90.89 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.314 -0.866 . . . . 0.0 109.265 179.445 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.14 -53.98 12.69 Favored Glycine 0 N--CA 1.496 2.697 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.634 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 48.0 mt -57.32 -57.2 13.66 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.341 -1.094 . . . . 0.0 109.941 -179.462 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.553 ' OH ' ' HD2' ' A' ' 42' ' ' ARG . 78.5 t80 -50.67 -43.97 57.61 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.583 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.617 ' O ' ' N ' ' A' ' 39' ' ' GLN . 27.4 t80 -57.57 -54.79 42.82 Favored 'General case' 0 C--O 1.195 -1.811 0 O-C-N 121.502 -0.749 . . . . 0.0 109.402 179.456 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -49.42 -34.35 16.24 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 119.932 -1.73 . . . . 0.0 111.096 179.781 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 9.6 mp -57.94 -65.12 0.69 Allowed 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.082 -1.011 . . . . 0.0 110.408 -179.638 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 -99.11 -33.15 10.9 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.256 -0.903 . . . . 0.0 109.03 179.549 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.617 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 73.2 47.99 0.18 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.868 0.842 . . . . 0.0 110.099 179.088 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 m -140.57 166.26 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 178.544 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -77.61 145.52 36.73 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.854 -1.154 . . . . 0.0 109.396 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.553 ' HD2' ' OH ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -146.22 150.23 40.77 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 120.918 -1.114 . . . . 0.0 110.125 -179.686 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.445 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 5.9 Cg_exo -57.18 147.43 76.09 Favored 'Trans proline' 0 C--N 1.314 -1.243 0 C-N-CA 122.227 1.952 . . . . 0.0 110.796 -179.947 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.512 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.4 OUTLIER -86.59 23.93 1.54 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.498 -0.751 . . . . 0.0 110.591 179.993 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 70.5 p -68.67 -12.69 61.69 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.999 -1.063 . . . . 0.0 110.336 179.374 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -86.11 -31.27 21.97 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.252 -0.905 . . . . 0.0 110.303 -179.83 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.486 ' HG2' ' N ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -80.62 158.49 25.67 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.11 -0.994 . . . . 0.0 109.775 -179.814 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.486 ' N ' ' HG2' ' A' ' 47' ' ' ARG . 10.3 tttp -131.78 173.56 11.04 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.054 -1.029 . . . . 0.0 109.93 179.78 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.48 -37.72 77.38 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.354 -0.841 . . . . 0.0 109.586 179.854 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -97.63 132.32 10.93 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 179.158 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.438 ' CG2' ' CG2' ' A' ' 16' ' ' THR . 4.8 mt -53.47 104.04 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.387 -1.066 . . . . 0.0 109.912 -179.626 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . 0.459 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 1.9 mt-30 -46.5 96.76 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.009 0 O-C-N 122.047 -0.408 . . . . 0.0 111.041 -179.363 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -121.86 153.04 38.91 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.949 -1.094 . . . . 0.0 110.859 179.583 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.542 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 1.6 ptm180 -154.17 -154.45 0.52 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 115.541 -0.754 . . . . 0.0 108.971 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . 0.481 ' N ' ' HG3' ' A' ' 54' ' ' ARG . 23.7 t-20 -58.54 121.09 10.1 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 177.988 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . 0.402 ' NH1' ' HG2' ' A' ' 56' ' ' ARG . 0.0 OUTLIER -86.14 -169.43 2.64 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.419 -0.8 . . . . 0.0 111.083 -178.449 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 O-C-N 121.305 -0.872 . . . . 0.0 109.645 179.904 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.923 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.9 -30.26 4.89 Favored Glycine 0 N--CA 1.496 2.682 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 -179.202 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' THR . . . . . 0.458 HG23 ' HB2' ' A' ' 26' ' ' PRO . 4.9 m -72.18 88.93 1.15 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.266 -1.138 . . . . 0.0 109.472 179.505 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.9 m -78.73 120.19 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.124 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.508 ' HB2' HG22 ' A' ' 12' ' ' THR . 45.3 t -49.42 112.78 0.69 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.191 -0.943 . . . . 0.0 110.585 -178.411 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 71.0 m -57.19 -16.97 9.29 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.412 -0.805 . . . . 0.0 110.839 179.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . 0.472 ' CB ' ' SG ' ' A' ' 31' ' ' CYS . 25.3 m-20 -98.87 -31.01 12.07 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.002 -1.061 . . . . 0.0 111.437 -179.206 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.484 ' SG ' ' HD3' ' A' ' 47' ' ' ARG . 19.1 p -138.73 22.02 2.68 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.468 -1.395 . . . . 0.0 111.474 179.294 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER 44.59 21.02 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.303 -0.873 . . . . 0.0 112.692 178.851 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.508 HG22 ' HB2' ' A' ' 7' ' ' CYS . 6.1 t -80.78 130.48 35.09 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.579 -1.325 . . . . 0.0 109.749 179.927 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.0 p -90.47 -4.93 56.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.29 -0.881 . . . . 0.0 109.42 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 31.9 p -118.65 121.45 40.18 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -0.947 . . . . 0.0 110.085 -179.616 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.524 HG22 ' CZ2' ' A' ' 18' ' ' TRP . 21.5 p -143.58 160.88 39.85 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.323 -0.861 . . . . 0.0 110.117 179.475 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.3 p -81.52 -47.45 13.1 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.877 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.497 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 10.9 mt -130.94 109.92 10.89 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.686 -0.633 . . . . 0.0 109.37 179.206 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.524 ' CZ2' HG22 ' A' ' 15' ' ' THR . 16.7 m95 -79.34 85.83 5.13 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.577 -0.702 . . . . 0.0 109.79 -179.615 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . 0.545 ' HD3' ' HA ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -77.57 93.64 4.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.073 -1.017 . . . . 0.0 109.335 179.556 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -68.06 124.21 22.77 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.33 -0.856 . . . . 0.0 110.149 -179.27 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -81.26 141.17 49.46 Favored Pre-proline 0 N--CA 1.499 1.989 0 O-C-N 121.361 -0.837 . . . . 0.0 109.559 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -54.36 -41.17 78.91 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 122.515 2.144 . . . . 0.0 110.933 -179.766 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.3 mtp -59.78 -20.44 56.74 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.32 -0.863 . . . . 0.0 109.95 179.386 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.54 39.66 1.44 Allowed Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 179.827 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -127.6 91.19 46.3 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.379 -1.071 . . . . 0.0 110.146 -179.818 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 2.6 Cg_endo -64.36 100.3 0.32 Allowed 'Trans proline' 0 C--N 1.311 -1.424 0 C-N-CA 122.203 1.935 . . . . 0.0 109.524 179.064 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.465 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.0 m -109.12 153.88 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 120.869 -1.144 . . . . 0.0 110.998 -179.476 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.507 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 16.0 p -81.8 138.88 35.06 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.545 ' HA ' ' HD3' ' A' ' 19' ' ' ARG . 6.0 t-20 -38.12 -36.64 0.22 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.781 -0.575 . . . . 0.0 111.812 -178.64 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.69 -43.07 81.01 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.271 -0.893 . . . . 0.0 111.76 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.472 ' SG ' ' CB ' ' A' ' 9' ' ' ASN . 1.8 m -57.98 -41.01 82.07 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.001 -1.062 . . . . 0.0 109.621 -179.671 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . 0.456 ' HA3' ' CZ ' ' A' ' 19' ' ' ARG . . . -74.02 -39.59 45.46 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 -179.925 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.0 mt -64.65 -65.15 0.71 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.484 -1.01 . . . . 0.0 110.26 -179.616 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.597 ' CD1' ' HB3' ' A' ' 42' ' ' ARG . 23.3 t80 -51.74 -39.98 59.44 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.233 -0.917 . . . . 0.0 108.843 179.77 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.485 ' O ' ' N ' ' A' ' 39' ' ' GLN . 60.2 t80 -53.59 -47.81 69.81 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.564 -0.71 . . . . 0.0 109.633 179.198 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -66.99 -38.67 86.44 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.208 -0.933 . . . . 0.0 110.14 -179.902 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.27 -53.21 8.67 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.293 -0.879 . . . . 0.0 110.031 -179.564 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.5 ' CB ' HG23 ' A' ' 40' ' ' VAL . 37.6 m-70 -111.53 6.37 20.07 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.351 -0.843 . . . . 0.0 109.549 179.156 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 35' ' ' TYR . 3.2 tp-100 49.22 32.67 4.42 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.431 -0.793 . . . . 0.0 110.133 -178.751 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.5 HG23 ' CB ' ' A' ' 38' ' ' HIS . 4.0 m -134.08 -174.44 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.503 -0.748 . . . . 0.0 109.558 179.826 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -61.97 172.5 1.35 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.237 -0.915 . . . . 0.0 110.319 179.574 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.597 ' HB3' ' CD1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -133.36 131.38 21.51 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.24 -0.912 . . . . 0.0 109.451 -179.867 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.24 112.93 1.85 Allowed 'Trans proline' 0 C--N 1.315 -1.218 0 C-N-CA 122.135 1.89 . . . . 0.0 110.335 179.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.486 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -72.74 -7.24 49.61 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.21 -0.931 . . . . 0.0 110.378 179.779 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 75.0 p -54.42 -20.66 7.9 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.05 -1.031 . . . . 0.0 110.003 178.631 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.03 -15.36 62.55 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.139 -0.975 . . . . 0.0 110.725 179.627 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 12.0 mmm180 -56.56 148.03 20.69 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 120.719 -1.238 . . . . 0.0 110.24 -179.785 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.85 -162.92 1.27 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.42 -0.8 . . . . 0.0 109.852 -179.916 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -79.99 -41.17 26.4 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.12 -0.988 . . . . 0.0 109.884 179.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -133.15 165.89 23.88 Favored Glycine 0 N--CA 1.498 2.793 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.4 mt -56.59 125.87 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.195 -1.18 . . . . 0.0 109.973 179.87 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.63 154.53 32.58 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.561 -0.712 . . . . 0.0 109.589 179.247 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.84 165.32 36.83 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.977 -1.077 . . . . 0.0 109.252 179.1 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.42 ' NH1' ' CG ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -150.46 -172.68 4.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.539 -0.725 . . . . 0.0 109.382 -179.421 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -51.69 118.69 3.55 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.106 -0.996 . . . . 0.0 108.718 179.228 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -47.43 140.58 5.62 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.581 -0.7 . . . . 0.0 110.351 -178.985 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.2 ttmt . . . . . 0 N--CA 1.497 1.891 0 O-C-N 121.581 -0.699 . . . . 0.0 110.149 -179.742 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.3 -23.83 5.41 Favored Glycine 0 N--CA 1.496 2.649 0 N-CA-C 109.266 -1.534 . . . . 0.0 109.266 -178.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.0 m -69.13 93.36 0.59 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.31 -1.112 . . . . 0.0 109.843 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.68 129.74 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 178.41 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' CYS . . . . . 0.6 ' HB2' HG23 ' A' ' 12' ' ' THR . 6.9 t -45.13 111.98 0.39 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.523 -0.736 . . . . 0.0 111.132 -178.638 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -60.58 -13.32 13.53 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.25 -0.906 . . . . 0.0 110.671 179.679 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -105.03 -28.59 10.96 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.776 -1.203 . . . . 0.0 111.589 -179.309 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' CYS . . . . . 0.602 ' SG ' ' HD2' ' A' ' 47' ' ' ARG . 9.4 p -138.71 24.7 2.62 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.637 -1.289 . . . . 0.0 110.59 179.005 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 1.3 pt20 38.45 25.98 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 179.132 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' THR . . . . . 0.6 HG23 ' HB2' ' A' ' 7' ' ' CYS . 3.8 t -90.1 124.18 34.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.589 -1.319 . . . . 0.0 109.816 179.228 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.07 -23.96 21.28 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.447 -0.783 . . . . 0.0 109.711 -179.867 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' THR . . . . . 0.477 ' HB ' HG13 ' A' ' 51' ' ' ILE . 2.9 p -89.86 94.13 9.7 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.225 -0.922 . . . . 0.0 109.173 179.807 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' THR . . . . . 0.467 HG22 ' CZ2' ' A' ' 18' ' ' TRP . 5.2 p -117.71 149.59 40.5 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.269 -0.895 . . . . 0.0 110.059 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 30.7 p -74.04 -33.72 63.83 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 179.145 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' LEU . . . . . 0.421 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 73.3 mt -146.32 108.52 4.42 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.34 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' TRP . . . . . 0.467 ' CZ2' HG22 ' A' ' 15' ' ' THR . 9.6 m95 -65.39 86.33 0.07 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.382 -0.824 . . . . 0.0 109.696 -179.774 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -76.98 80.25 3.52 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.433 -0.792 . . . . 0.0 109.381 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ARG . . . . . 0.455 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -57.91 123.45 15.84 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.364 -0.835 . . . . 0.0 109.594 -179.832 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 t -78.58 145.99 68.53 Favored Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.346 -0.846 . . . . 0.0 109.912 -179.599 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -58.76 -23.17 65.28 Favored 'Trans proline' 0 C--N 1.319 -1.024 0 C-N-CA 122.443 2.095 . . . . 0.0 110.482 179.185 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.04 1.28 21.47 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.207 -0.933 . . . . 0.0 110.307 179.309 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.85 29.89 16.72 Favored Glycine 0 N--CA 1.497 2.741 0 N-CA-C 109.412 -1.475 . . . . 0.0 109.412 -179.562 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -121.34 101.03 44.4 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.406 -1.055 . . . . 0.0 110.339 -179.419 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 3.2 Cg_exo -63.11 99.69 0.23 Allowed 'Trans proline' 0 C--N 1.311 -1.417 0 C-N-CA 121.997 1.798 . . . . 0.0 109.605 178.48 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.513 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 1.6 m -110.34 154.56 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 CA-C-O 122.292 1.044 . . . . 0.0 111.024 -179.77 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.405 ' O ' ' C ' ' A' ' 29' ' ' ASN . 15.7 p -81.14 138.37 35.9 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.689 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' ASN . . . . . 0.421 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 3.5 t-20 -35.22 -46.8 0.37 Allowed 'General case' 0 N--CA 1.504 2.275 0 O-C-N 121.657 -0.652 . . . . 0.0 112.093 -178.551 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.15 -47.26 75.37 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.377 -0.827 . . . . 0.0 111.472 -179.339 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 3.4 m -57.19 -38.66 73.98 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.091 -1.006 . . . . 0.0 109.81 179.966 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -72.92 -36.52 57.36 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.991 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 81.0 mt -73.15 -66.22 0.71 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.432 -1.04 . . . . 0.0 110.09 -179.851 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' TYR . . . . . 0.453 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 80.2 t80 -46.34 -34.46 4.58 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.357 -0.839 . . . . 0.0 109.173 179.655 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' TYR . . . . . 0.632 ' O ' ' N ' ' A' ' 39' ' ' GLN . 30.5 t80 -63.47 -62.58 1.58 Allowed 'General case' 0 C--O 1.193 -1.886 0 O-C-N 121.285 -0.885 . . . . 0.0 109.009 178.746 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 tttm -48.06 -30.41 4.41 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 120.084 -1.635 . . . . 0.0 110.799 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 9.6 mp -57.33 -69.52 0.16 Allowed 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.198 -0.939 . . . . 0.0 109.971 179.734 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' HIS . . . . . 0.454 ' HB2' HG21 ' A' ' 40' ' ' VAL . 17.6 m-70 -99.38 -28.74 13.14 Favored 'General case' 0 N--CA 1.506 2.34 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.039 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.632 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.9 OUTLIER 76.19 49.0 0.07 Allowed 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 122.059 0.933 . . . . 0.0 110.346 179.21 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' VAL . . . . . 0.454 HG21 ' HB2' ' A' ' 38' ' ' HIS . 2.8 m -133.44 -178.87 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.558 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -59.1 161.05 5.53 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.641 -1.287 . . . . 0.0 110.022 179.779 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' ARG . . . . . 0.499 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -127.21 106.69 21.69 Favored Pre-proline 0 N--CA 1.498 1.962 0 O-C-N 121.041 -1.037 . . . . 0.0 109.759 -179.12 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.16 141.93 90.08 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 122.353 2.035 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' LEU . . . . . 0.544 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -84.8 5.52 28.3 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.257 -0.902 . . . . 0.0 110.785 179.953 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 54.6 p -61.24 -26.7 67.93 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.461 -1.399 . . . . 0.0 109.696 179.054 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.65 4.19 33.57 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.133 -0.979 . . . . 0.0 110.821 179.79 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' ARG . . . . . 0.602 ' HD2' ' SG ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -82.35 -174.9 5.41 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.567 -1.333 . . . . 0.0 109.621 179.636 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -151.43 156.9 41.59 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.124 -0.985 . . . . 0.0 109.416 179.793 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -55.03 -35.2 64.19 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.295 -0.878 . . . . 0.0 109.792 179.878 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.88 146.92 16.63 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 109.071 -1.612 . . . . 0.0 109.071 179.033 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' ILE . . . . . 0.477 HG13 ' HB ' ' A' ' 14' ' ' THR . 6.0 mt -50.22 120.62 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.345 -1.091 . . . . 0.0 109.852 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.79 151.57 33.81 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.404 -0.81 . . . . 0.0 109.563 179.814 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' THR . . . . . 0.419 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -155.49 165.04 37.82 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.266 -0.896 . . . . 0.0 109.419 179.445 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' ARG . . . . . 0.475 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 2.1 mtm-85 -145.64 -152.49 0.43 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.625 -0.672 . . . . 0.0 109.709 -179.5 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.58 122.56 16.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.112 -0.993 . . . . 0.0 109.105 179.324 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.06 112.82 0.48 Allowed 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.446 0.641 . . . . 0.0 110.752 -179.171 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.389 -0.819 . . . . 0.0 109.287 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.542 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.674 0 O4'-C1'-N19 110.345 3.182 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.542 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.732 1 O4'-C1'-N19 111.414 4.518 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.588 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.062 0 O4'-C1'-N19 110.723 3.654 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.588 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.01 0 O4'-C1'-N19 110.65 3.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.521 H2'' ' C8 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.824 0 O4'-C1'-N19 110.717 3.646 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.521 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.012 0 O4'-C1'-N19 110.755 3.694 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.463 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.825 1 O4'-C1'-N19 111.281 4.351 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.463 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.806 0 C3'-C2'-C1' 107.198 3.213 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.682 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.792 0 O4'-C1'-N19 110.865 3.831 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.682 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.227 1 O4'-C1'-N19 111.827 5.033 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.499 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.028 1 O4'-C1'-N19 111.081 4.101 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.55 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 P--O5' 1.611 1.763 0 O4'-C1'-N19 110.6 3.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.55 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.477 1 O4'-C1'-N19 111.082 4.102 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.443 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.532 2.564 1 O4'-C1'-N19 111.856 5.07 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.443 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.497 0 O4'-C1'-N19 110.946 3.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.959 1 O4'-C1'-N19 111.086 4.108 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 2.011 0 CA-C-O 120.745 0.307 . . . . 0.0 110.321 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.28 -31.69 72.99 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.085 -1.009 . . . . 0.0 110.092 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -51.91 138.6 24.1 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.299 -0.876 . . . . 0.0 109.619 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.32 -31.77 7.8 Favored Glycine 0 N--CA 1.494 2.549 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.448 HG22 ' CH2' ' A' ' 18' ' ' TRP . 3.5 m -63.5 91.69 0.06 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.343 -1.092 . . . . 0.0 109.137 178.984 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.411 HG22 ' O ' ' A' ' 6' ' ' VAL . 12.4 m -88.93 122.17 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.509 ' CB ' HG23 ' A' ' 12' ' ' THR . 49.5 t -49.57 118.06 2.57 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.336 -0.853 . . . . 0.0 110.602 -178.662 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.1 m -65.33 -7.71 14.81 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.411 -0.806 . . . . 0.0 111.115 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.8 m120 -107.78 -23.64 12.0 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 120.732 -1.23 . . . . 0.0 110.858 179.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.516 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 14.0 p -145.41 20.63 1.53 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.669 -1.269 . . . . 0.0 111.176 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.485 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER 45.05 20.31 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.451 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 178.71 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.509 HG23 ' CB ' ' A' ' 7' ' ' CYS . 14.1 t -77.4 135.78 38.35 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.34 -1.475 . . . . 0.0 109.655 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.3 p -95.0 -21.37 18.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.536 -0.728 . . . . 0.0 109.347 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.48 ' HB ' HG13 ' A' ' 51' ' ' ILE . 72.3 p -109.45 120.31 42.1 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.249 -0.907 . . . . 0.0 109.772 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.572 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 4.4 p -135.71 159.77 40.62 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.279 -0.888 . . . . 0.0 109.591 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.482 ' CG2' " H3'" ' C' ' 124' ' ' ' DA' . 6.0 p -83.54 -30.77 26.81 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.562 -0.711 . . . . 0.0 109.205 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.588 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 45.9 mt -142.13 91.3 2.33 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.345 -0.847 . . . . 0.0 109.371 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.458 ' CZ2' HG23 ' A' ' 15' ' ' THR . 18.5 m95 -64.2 109.1 1.75 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.296 -0.877 . . . . 0.0 109.806 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.54 ' HG3' ' O ' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -98.85 130.32 45.26 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.224 -0.922 . . . . 0.0 109.403 179.651 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.8 mmm180 -96.38 119.8 35.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.16 -0.963 . . . . 0.0 109.745 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.6 t -79.21 142.8 59.56 Favored Pre-proline 0 N--CA 1.499 2.018 0 O-C-N 121.206 -0.934 . . . . 0.0 109.478 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -54.32 -41.61 74.87 Favored 'Trans proline' 0 C--N 1.32 -0.959 0 C-N-CA 122.655 2.237 . . . . 0.0 111.0 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.7 mtm -62.05 -21.06 64.61 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.268 -0.895 . . . . 0.0 109.412 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.02 44.66 1.08 Allowed Glycine 0 N--CA 1.497 2.753 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -129.28 98.94 22.14 Favored Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.155 -1.203 . . . . 0.0 110.822 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -65.97 107.09 1.06 Allowed 'Trans proline' 0 C--N 1.314 -1.247 0 C-N-CA 122.101 1.867 . . . . 0.0 109.241 178.244 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.54 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 2.0 m -122.88 126.28 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 O-C-N 121.135 -0.978 . . . . 0.0 110.506 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.572 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.2 p -48.06 131.12 15.87 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.404 -0.81 . . . . 0.0 109.839 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.588 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 5.6 t-20 -35.09 -43.68 0.21 Allowed 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.837 -0.54 . . . . 0.0 112.156 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.422 ' HB1' ' OP2' ' C' ' 124' ' ' ' DA' . . . -51.43 -45.42 62.63 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.276 -0.89 . . . . 0.0 110.606 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.447 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 18.6 m -64.75 -37.44 87.59 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.331 -0.856 . . . . 0.0 108.999 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.29 -53.53 25.05 Favored Glycine 0 N--CA 1.495 2.602 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.518 ' O ' HD13 ' A' ' 37' ' ' LEU . 93.7 mt -55.74 -58.44 7.81 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.503 -0.998 . . . . 0.0 109.877 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.488 ' CZ ' ' HD2' ' A' ' 43' ' ' PRO . 11.4 t80 -47.28 -42.62 21.24 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.489 -0.757 . . . . 0.0 109.749 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.424 ' O ' ' HA ' ' A' ' 39' ' ' GLN . 40.4 t80 -52.29 -46.99 66.13 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.374 -0.829 . . . . 0.0 109.979 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.4 -38.1 77.8 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 120.82 -1.175 . . . . 0.0 110.206 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.518 HD13 ' O ' ' A' ' 33' ' ' LEU . 6.0 mp -42.97 -52.46 5.19 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.565 -0.709 . . . . 0.0 110.16 -179.326 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.451 ' CB ' HG21 ' A' ' 40' ' ' VAL . 78.6 m-70 -121.37 12.13 10.84 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.18 -0.95 . . . . 0.0 110.082 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.424 ' HA ' ' O ' ' A' ' 35' ' ' TYR . 8.4 tt0 50.13 34.92 9.13 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.356 -0.84 . . . . 0.0 110.141 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.451 HG21 ' CB ' ' A' ' 38' ' ' HIS . 2.9 m -135.96 -165.42 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 O-C-N 121.313 -0.867 . . . . 0.0 109.203 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.7 p30 -62.93 -173.82 0.06 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.224 -0.922 . . . . 0.0 110.254 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.447 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -146.41 106.97 4.11 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.283 -0.885 . . . . 0.0 109.884 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.488 ' HD2' ' CZ ' ' A' ' 34' ' ' TYR . 3.5 Cg_exo -60.34 128.01 24.8 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 C-N-CA 122.234 1.956 . . . . 0.0 110.08 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.516 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.9 OUTLIER -93.3 25.48 3.34 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.335 -0.853 . . . . 0.0 110.884 -179.299 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -6.91 29.67 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.031 -1.043 . . . . 0.0 110.849 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 57.8 mtm -102.93 -7.82 21.19 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.871 -1.143 . . . . 0.0 110.61 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.513 ' NH1' ' HG3' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -81.64 164.76 21.61 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.869 -1.144 . . . . 0.0 110.451 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.2 -169.12 3.23 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.365 -0.835 . . . . 0.0 109.719 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -78.84 -9.53 59.5 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.093 -1.004 . . . . 0.0 110.699 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -137.17 145.08 16.8 Favored Glycine 0 N--CA 1.499 2.882 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.48 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.1 mt -54.18 124.3 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.405 -1.056 . . . . 0.0 110.108 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.49 159.59 33.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.451 -0.781 . . . . 0.0 109.4 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.32 163.34 40.25 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.011 -1.055 . . . . 0.0 109.378 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -149.86 -163.26 1.74 Allowed 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.4 93.93 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.042 -1.036 . . . . 0.0 108.515 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.36 150.19 1.36 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.566 -0.709 . . . . 0.0 109.972 -179.317 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt -51.55 126.03 16.3 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.358 -0.839 . . . . 0.0 109.641 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.2 p -43.99 129.22 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.711 -0.618 . . . . 0.0 110.465 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.47 65.93 0.95 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 30.6 t . . . . . 0 N--CA 1.498 1.929 0 O-C-N 121.157 -0.964 . . . . 0.0 109.071 -179.702 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.517 ' C6 ' ' C6 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.667 0 O4'-C1'-N19 110.75 3.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.517 ' C6 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.74 1 O4'-C1'-N19 111.584 4.73 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.408 " O5'" H2'' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.353 1 O4'-C1'-N19 111.012 4.014 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.517 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.406 1 O4'-C1'-N19 111.472 4.59 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.517 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C1'-N19 110.504 3.381 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.648 0 O4'-C1'-N19 110.759 3.699 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.441 1.598 1 O4'-C1'-N19 111.361 4.451 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.408 " H5'" ' CZ ' ' A' ' 54' ' ' ARG . . . . . . . . 0 O4'--C1' 1.442 1.711 0 O4'-C1'-N19 110.755 3.694 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.617 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.987 0 O4'-C1'-N19 110.823 3.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.617 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.58 1 O4'-C1'-N19 111.938 5.173 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.513 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.564 1 O4'-C1'-N19 111.148 4.185 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.513 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 P--O5' 1.612 1.872 0 O4'-C1'-N19 110.501 3.376 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.511 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.355 0 O4'-C1'-N19 110.499 3.374 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.619 ' H73' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.528 2.178 1 O4'-C1'-N19 112.356 5.696 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.479 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.705 0 O4'-C1'-N19 110.916 3.895 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.781 0 O4'-C1'-N19 110.686 3.608 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.97 0 N-CA-C 111.389 0.144 . . . . 0.0 111.389 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -86.58 62.06 7.19 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.499 -1.376 . . . . 0.0 109.971 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.78 123.67 18.18 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.201 -0.937 . . . . 0.0 109.054 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.44 -30.44 3.45 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.369 -1.493 . . . . 0.0 109.369 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.475 HG23 ' CH2' ' A' ' 18' ' ' TRP . 72.8 m -72.09 86.15 1.04 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.088 -1.242 . . . . 0.0 109.316 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.3 m -88.46 112.81 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 179.177 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.531 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 52.9 t -47.99 108.05 0.15 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.466 -0.771 . . . . 0.0 110.732 -178.43 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.9 m -59.76 -14.96 16.84 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.309 -0.869 . . . . 0.0 111.129 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.511 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.9 OUTLIER -90.36 -30.11 17.63 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.032 -1.043 . . . . 0.0 110.739 -179.788 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.546 ' SG ' ' CG2' ' A' ' 12' ' ' THR . 16.3 p -143.25 23.81 1.82 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.627 -1.296 . . . . 0.0 110.908 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.474 ' N ' ' O ' ' A' ' 7' ' ' CYS . 7.1 mt-30 44.61 22.56 0.06 Allowed 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.354 -0.842 . . . . 0.0 112.201 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.546 ' CG2' ' SG ' ' A' ' 10' ' ' CYS . 6.7 t -89.19 125.63 35.15 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.515 -1.366 . . . . 0.0 110.051 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.6 t -90.96 -17.11 26.91 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.638 -0.664 . . . . 0.0 109.639 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.491 ' HB ' HG13 ' A' ' 51' ' ' ILE . 23.0 p -101.42 115.63 30.93 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.252 -0.905 . . . . 0.0 109.035 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.496 HG23 ' CZ3' ' A' ' 18' ' ' TRP . 6.9 p -135.44 153.17 51.86 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.218 -0.926 . . . . 0.0 110.211 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.619 ' HB ' ' H73' ' C' ' 125' ' ' ' DT' . 40.7 p -83.43 -34.74 25.4 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.556 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 35.4 mt -137.61 96.96 3.34 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.475 -0.766 . . . . 0.0 109.312 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.496 ' CZ3' HG23 ' A' ' 15' ' ' THR . 8.6 m95 -62.93 110.96 1.95 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.153 -0.967 . . . . 0.0 109.843 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.34 104.51 14.13 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.358 -0.839 . . . . 0.0 109.237 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.421 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -73.21 115.14 12.19 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.098 . . . . 0.0 108.812 179.784 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.523 ' HB3' ' HG2' ' A' ' 23' ' ' MET . 0.2 OUTLIER -67.95 144.49 97.2 Favored Pre-proline 0 N--CA 1.5 2.064 0 O-C-N 121.21 -0.931 . . . . 0.0 110.293 -179.118 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -55.18 -40.84 83.68 Favored 'Trans proline' 0 C--N 1.319 -1.013 0 C-N-CA 122.867 2.378 . . . . 0.0 110.952 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.523 ' HG2' ' HB3' ' A' ' 21' ' ' SER . 1.4 ptt? -54.73 -23.8 19.34 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.401 -0.812 . . . . 0.0 109.986 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.57 37.18 1.47 Allowed Glycine 0 N--CA 1.497 2.713 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -136.23 116.19 11.13 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 120.864 -1.374 . . . . 0.0 110.322 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.43 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 5.1 Cg_exo -62.06 106.13 0.44 Allowed 'Trans proline' 0 C--N 1.316 -1.177 0 C-N-CA 122.321 2.014 . . . . 0.0 110.026 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.531 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.8 m -120.37 126.01 74.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.104 -0.997 . . . . 0.0 110.665 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.408 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 9.7 p -49.27 133.67 19.13 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 121.443 0.64 . . . . 0.0 109.456 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.556 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 8.1 t-20 -37.9 -45.43 0.86 Allowed 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.578 -0.701 . . . . 0.0 111.577 -178.961 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.71 -46.49 40.77 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.208 -0.933 . . . . 0.0 110.96 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.511 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 6.9 m -60.24 -47.05 87.62 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.006 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.44 -32.44 64.38 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 109.626 -1.389 . . . . 0.0 109.626 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.512 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 81.9 mt -75.85 -64.01 1.18 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.512 -0.993 . . . . 0.0 109.284 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.416 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 9.3 t80 -47.13 -38.71 12.02 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.055 -1.028 . . . . 0.0 109.143 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.438 ' O ' ' N ' ' A' ' 39' ' ' GLN . 31.5 t80 -60.18 -49.54 77.23 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.48 -0.763 . . . . 0.0 109.787 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.512 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -62.06 -25.5 67.72 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.671 -1.268 . . . . 0.0 110.671 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.497 HD11 ' O ' ' A' ' 33' ' ' LEU . 6.5 mp -62.19 -63.75 1.14 Allowed 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.206 -0.934 . . . . 0.0 110.268 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.529 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 69.8 m-70 -106.93 13.47 27.63 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.322 -0.862 . . . . 0.0 110.366 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER 42.98 33.02 0.46 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.679 -0.638 . . . . 0.0 111.219 -179.557 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' CZ ' ' A' ' 42' ' ' ARG . 5.4 m -136.01 164.72 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 O-C-N 121.15 -0.969 . . . . 0.0 110.176 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -84.45 136.31 33.9 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.438 -0.789 . . . . 0.0 108.974 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.492 ' CZ ' HG22 ' A' ' 40' ' ' VAL . 2.5 mpt_? -131.78 148.07 68.5 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 121.273 -0.892 . . . . 0.0 109.994 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -63.02 144.33 92.67 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 122.44 2.093 . . . . 0.0 111.011 -179.848 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.539 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -84.49 41.63 0.85 Allowed 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.503 -0.748 . . . . 0.0 110.709 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.4 p -63.78 -17.32 62.95 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.136 -0.977 . . . . 0.0 110.373 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 32.6 ttp -97.45 -2.12 42.78 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.122 -0.986 . . . . 0.0 110.609 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.461 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 1.8 tpt180 -63.64 145.04 56.49 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 120.645 -1.285 . . . . 0.0 110.486 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.97 -176.27 2.86 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.405 -0.809 . . . . 0.0 109.943 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -78.45 -40.7 34.92 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.633 -0.667 . . . . 0.0 110.177 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.43 165.76 19.49 Favored Glycine 0 N--CA 1.5 2.937 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.491 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.8 mt -58.13 123.78 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.52 -0.988 . . . . 0.0 110.217 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.86 159.29 31.12 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.556 -0.715 . . . . 0.0 109.856 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.98 162.91 40.28 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.272 -0.892 . . . . 0.0 109.275 179.079 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.422 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -150.59 -161.82 1.42 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.703 -0.623 . . . . 0.0 109.323 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.74 91.83 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.003 -1.061 . . . . 0.0 108.716 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.43 130.69 16.87 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.602 -0.686 . . . . 0.0 110.215 -178.989 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.35 132.61 44.37 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.504 -0.748 . . . . 0.0 110.008 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 44.1 t -85.02 160.46 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.501 -0.749 . . . . 0.0 109.133 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 7.9 t -53.59 108.72 0.37 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.208 -0.932 . . . . 0.0 109.865 -179.957 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.499 2.018 0 O-C-N 121.622 -0.674 . . . . 0.0 109.98 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.56 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.444 1.82 0 O4'-C1'-N19 110.361 3.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.56 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.716 1 O4'-C1'-N19 111.408 4.51 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.623 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.827 0 O4'-C1'-N19 110.847 3.808 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.623 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.685 1 O4'-C1'-N19 111.089 4.111 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.53 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.797 0 O4'-C1'-N19 110.832 3.79 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.49 " O5'" H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.441 1.597 0 O4'-C1'-N19 110.796 3.745 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.443 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.566 1 O4'-C1'-N19 111.365 4.456 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.76 0 O4'-C1'-N19 110.634 3.543 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.646 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.651 1 O4'-C1'-N19 111.677 4.846 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.646 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.468 1 O4'-C1'-N19 111.926 5.158 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.452 ' C5 ' ' C2 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.802 1 O4'-C1'-N19 111.475 4.594 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.483 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.416 0 O4'-C1'-N19 110.582 3.477 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.488 " C5'" ' HG2' ' A' ' 52' ' ' GLN . . . . . . . . 0 C5'--C4' 1.531 2.51 0 O4'-C1'-N19 110.973 3.966 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.706 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.466 1 O4'-C1'-N19 112.127 5.409 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.537 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.186 0 O4'-C1'-N19 110.969 3.962 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.428 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.532 2.649 0 O4'-C1'-N19 110.813 3.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt . . . . . 0 N--CA 1.497 1.921 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.06 59.57 1.41 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.139 -0.976 . . . . 0.0 109.804 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.31 124.62 18.65 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.335 -0.853 . . . . 0.0 109.214 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.84 -45.7 1.14 Allowed Glycine 0 N--CA 1.494 2.563 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.428 ' HB ' ' CZ2' ' A' ' 18' ' ' TRP . 3.9 m -65.43 102.51 0.7 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.118 -1.225 . . . . 0.0 109.503 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.9 m -104.01 113.22 40.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.545 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 43.7 t -51.1 107.31 0.17 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 109.536 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.6 m -57.79 -17.77 17.79 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.099 -1.0 . . . . 0.0 110.918 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.442 ' HB2' HG11 ' A' ' 27' ' ' VAL . 3.0 m120 -86.14 -30.88 22.17 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.102 -0.999 . . . . 0.0 111.016 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.5 p -142.72 23.02 1.95 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.571 -1.33 . . . . 0.0 111.437 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.455 ' N ' ' O ' ' A' ' 7' ' ' CYS . 13.0 mm100 42.29 35.35 0.6 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.5 -0.75 . . . . 0.0 112.386 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.496 HG21 HG22 ' A' ' 15' ' ' THR . 5.2 t -90.56 135.47 33.68 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.643 -1.286 . . . . 0.0 109.671 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.4 p -93.72 -18.46 22.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.537 -0.727 . . . . 0.0 109.749 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.494 ' HB ' HG13 ' A' ' 51' ' ' ILE . 69.3 p -111.58 126.11 54.65 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.023 -1.048 . . . . 0.0 109.329 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.496 HG22 HG21 ' A' ' 12' ' ' THR . 11.9 p -138.44 151.79 47.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.206 -0.934 . . . . 0.0 110.496 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.706 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 73.3 p -77.1 -32.75 56.82 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.6 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 52.4 mt -146.46 110.14 4.88 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 179.0 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.429 ' CZ2' HG21 ' A' ' 15' ' ' THR . 13.2 m95 -72.29 120.25 17.63 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.088 -1.008 . . . . 0.0 110.373 -179.194 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -106.51 82.17 1.69 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.491 -0.755 . . . . 0.0 109.45 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.464 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 6.7 tpp180 -60.95 118.45 6.73 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.418 -0.801 . . . . 0.0 109.377 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.478 ' HB3' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -82.63 143.53 47.41 Favored Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 121.326 -0.858 . . . . 0.0 109.785 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -55.97 -41.8 73.39 Favored 'Trans proline' 0 C--N 1.321 -0.89 0 C-N-CA 122.649 2.233 . . . . 0.0 111.103 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 mmt -56.39 -24.2 43.07 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.261 -0.899 . . . . 0.0 109.506 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.55 36.97 1.5 Allowed Glycine 0 N--CA 1.497 2.745 0 N-CA-C 109.914 -1.275 . . . . 0.0 109.914 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.478 ' O ' ' HB3' ' A' ' 21' ' ' SER . 15.2 m-20 -134.18 99.22 13.58 Favored Pre-proline 0 N--CA 1.495 1.775 0 O-C-N 121.192 -1.181 . . . . 0.0 110.388 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.545 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.8 Cg_endo -63.54 118.67 5.59 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 C-N-CA 122.039 1.826 . . . . 0.0 110.208 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.483 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.1 m -125.28 128.82 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 CA-C-O 121.868 0.842 . . . . 0.0 110.3 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.6 p -53.39 135.51 39.1 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.296 0.57 . . . . 0.0 109.73 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.6 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 22.9 t-20 -38.33 -47.2 1.19 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.627 -0.67 . . . . 0.0 112.035 -178.654 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.57 -46.13 27.74 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.223 -0.923 . . . . 0.0 110.858 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 22.6 m -65.48 -42.93 91.66 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.256 -0.903 . . . . 0.0 108.789 179.455 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.01 -50.37 66.13 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 110.459 -1.056 . . . . 0.0 110.459 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.463 ' HG ' ' OD1' ' A' ' 29' ' ' ASN . 68.1 mt -59.04 -66.72 0.46 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.369 -1.077 . . . . 0.0 109.608 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.502 ' CZ ' ' HG3' ' A' ' 42' ' ' ARG . 29.8 t80 -43.84 -38.46 3.32 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.558 -0.714 . . . . 0.0 109.687 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.548 ' O ' ' N ' ' A' ' 39' ' ' GLN . 15.9 t80 -62.02 -46.12 90.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.307 -0.87 . . . . 0.0 110.591 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.45 ' HE2' ' HA ' ' A' ' 33' ' ' LEU . 0.1 OUTLIER -60.37 -22.34 63.19 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.219 -1.551 . . . . 0.0 110.251 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.448 HD12 ' O ' ' A' ' 33' ' ' LEU . 7.2 mp -82.11 -55.54 4.5 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.021 -1.049 . . . . 0.0 110.027 -179.291 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.48 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 34.5 m-70 -97.44 -27.33 14.5 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.249 -0.907 . . . . 0.0 110.49 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 70.35 24.44 4.71 Favored 'General case' 0 N--CA 1.502 2.168 0 CA-C-O 121.591 0.71 . . . . 0.0 111.204 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.6 m -124.83 164.6 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 121.015 -1.053 . . . . 0.0 109.984 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -83.55 151.6 25.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.513 -0.742 . . . . 0.0 109.773 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.502 ' HG3' ' CZ ' ' A' ' 34' ' ' TYR . 13.2 mmt180 -133.84 147.65 65.11 Favored Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.387 -0.82 . . . . 0.0 110.002 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.424 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 1.0 OUTLIER -65.64 150.41 86.42 Favored 'Trans proline' 0 C--N 1.316 -1.145 0 C-N-CA 122.541 2.161 . . . . 0.0 110.656 179.671 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.459 ' O ' ' HB3' ' A' ' 47' ' ' ARG . 1.0 OUTLIER -68.6 0.92 3.57 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.192 -0.942 . . . . 0.0 110.876 179.462 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -35.08 45.46 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.936 -1.102 . . . . 0.0 110.257 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.59 -29.14 41.1 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.11 -0.994 . . . . 0.0 109.724 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.459 ' HB3' ' O ' ' A' ' 44' ' ' LEU . 0.5 OUTLIER -50.16 142.6 9.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.325 -0.859 . . . . 0.0 110.09 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.48 172.27 7.63 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.469 -0.769 . . . . 0.0 109.859 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -66.53 -66.25 0.58 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.337 -0.852 . . . . 0.0 109.853 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -117.0 164.4 12.41 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.494 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.0 mt -46.49 123.1 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.468 -1.019 . . . . 0.0 110.311 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.49 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -77.18 166.54 23.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.364 -0.835 . . . . 0.0 109.482 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.49 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.67 162.21 40.62 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.335 -0.853 . . . . 0.0 108.985 178.704 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -143.32 -162.06 1.38 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.54 -0.725 . . . . 0.0 109.661 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -62.42 117.14 5.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.98 -1.075 . . . . 0.0 109.089 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.53 134.63 19.27 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.541 -0.725 . . . . 0.0 110.898 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt -62.81 148.06 48.09 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.64 -0.662 . . . . 0.0 109.976 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 5.0 p -59.95 143.91 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.337 -0.852 . . . . 0.0 109.306 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.08 137.75 51.47 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.203 -0.936 . . . . 0.0 109.491 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.813 0 O-C-N 121.466 -0.772 . . . . 0.0 109.347 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.57 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.722 0 O4'-C1'-N19 110.361 3.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.57 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.757 1 O4'-C1'-N19 111.76 4.95 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.438 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.122 0 O4'-C1'-N19 110.916 3.895 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.47 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.179 0 O4'-C1'-N19 110.972 3.965 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.47 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.937 0 O4'-C1'-N19 110.664 3.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.893 0 O4'-C1'-N19 110.641 3.551 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.411 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.678 1 O4'-C1'-N19 111.268 4.335 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.411 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.78 0 O4'-C1'-N19 110.316 3.145 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.654 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.743 0 O4'-C1'-N19 110.908 3.885 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.654 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.538 1 O4'-C1'-N19 112.075 5.344 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.558 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.424 1 O4'-C1'-N19 111.177 4.221 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.558 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.845 0 O4'-C1'-N19 110.495 3.368 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.525 " H3'" ' CG2' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.532 2.605 0 O4'-C1'-N19 110.289 3.111 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.666 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.787 1 O4'-C1'-N19 112.551 5.939 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.494 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.752 0 O4'-C1'-N19 110.949 3.936 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.433 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.53 2.42 0 O4'-C1'-N19 110.742 3.677 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? . . . . . 0 N--CA 1.498 1.943 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -30.57 71.67 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.193 -0.942 . . . . 0.0 109.172 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.51 111.17 3.98 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.375 -0.828 . . . . 0.0 109.045 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.3 -15.05 7.75 Favored Glycine 0 N--CA 1.497 2.729 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.487 HG22 ' HB2' ' A' ' 26' ' ' PRO . 5.9 m -66.56 92.6 0.21 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.217 -1.167 . . . . 0.0 109.155 179.475 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 22.3 m -84.66 131.0 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.066 -1.021 . . . . 0.0 108.27 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.54 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 17.3 t -59.02 116.42 3.8 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.288 -0.882 . . . . 0.0 110.765 -178.722 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.1 m -62.01 -12.46 18.87 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.368 -0.832 . . . . 0.0 110.83 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 7.8 m120 -106.8 -25.31 11.76 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.946 -1.096 . . . . 0.0 111.516 -179.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.606 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 10.8 p -142.69 18.39 2.0 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.65 -1.281 . . . . 0.0 111.255 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 46.83 21.34 0.14 Allowed 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.405 -0.809 . . . . 0.0 112.555 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.552 HG21 HG23 ' A' ' 15' ' ' THR . 7.5 t -87.14 121.83 30.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.513 -1.367 . . . . 0.0 109.849 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.29 -26.67 21.02 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.461 ' HB ' HG13 ' A' ' 51' ' ' ILE . 6.3 p -89.14 96.22 10.63 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.427 -0.796 . . . . 0.0 108.958 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.552 HG23 HG21 ' A' ' 12' ' ' THR . 5.3 p -118.02 166.41 12.57 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.014 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.666 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 69.4 p -96.02 -38.06 10.37 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.686 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 17.0 mt -137.4 90.56 2.52 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.305 -0.872 . . . . 0.0 108.662 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.502 ' CZ2' HG22 ' A' ' 15' ' ' THR . 10.8 m95 -54.12 113.59 1.3 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.118 -0.989 . . . . 0.0 110.433 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.477 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 3.0 tpp180 -99.75 86.18 3.26 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.276 -0.89 . . . . 0.0 109.014 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 1.4 mmm180 -71.2 90.93 0.92 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.281 -0.887 . . . . 0.0 109.019 179.893 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.3 t -55.24 142.65 57.98 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.456 -0.777 . . . . 0.0 110.254 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -56.68 -30.89 85.68 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 C-N-CA 122.682 2.254 . . . . 0.0 110.976 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.28 -22.99 62.02 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.314 -0.866 . . . . 0.0 109.534 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.35 40.74 1.6 Allowed Glycine 0 N--CA 1.496 2.685 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -136.18 105.05 9.47 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.246 -1.15 . . . . 0.0 110.347 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.487 ' HB2' HG22 ' A' ' 5' ' ' THR . 2.3 Cg_endo -64.98 91.96 0.2 Allowed 'Trans proline' 0 C--N 1.314 -1.283 0 C-N-CA 122.337 2.025 . . . . 0.0 109.914 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.54 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.5 m -109.99 125.61 67.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.057 -1.027 . . . . 0.0 110.573 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.479 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.6 p -49.21 133.5 19.06 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.591 -0.693 . . . . 0.0 110.189 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.686 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 4.7 t-20 -39.92 -40.16 0.96 Allowed 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.577 -0.702 . . . . 0.0 111.586 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.54 -43.27 65.08 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.113 -0.992 . . . . 0.0 110.047 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 6.5 m -64.29 -41.52 96.83 Favored 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.55 -36.55 93.36 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 178.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.416 ' HB3' ' C7 ' ' C' ' 123' ' ' ' DT' . 83.5 mt -73.3 -62.97 1.29 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.545 -0.974 . . . . 0.0 110.168 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.429 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 89.2 t80 -51.81 -34.43 40.16 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.128 -0.983 . . . . 0.0 109.141 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.469 ' O ' ' N ' ' A' ' 39' ' ' GLN . 36.0 t80 -58.0 -52.68 64.52 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.428 -0.795 . . . . 0.0 109.22 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 tttp -55.08 -31.33 61.1 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.074 -1.016 . . . . 0.0 110.433 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.429 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 2.2 mp -61.29 -68.11 0.34 Allowed 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.215 -0.928 . . . . 0.0 110.576 -179.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.471 ' O ' ' HG3' ' A' ' 39' ' ' GLN . 75.6 m-70 -96.9 10.0 40.32 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.053 -1.03 . . . . 0.0 110.412 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.471 ' HG3' ' O ' ' A' ' 38' ' ' HIS . 1.9 pt20 45.14 31.32 0.74 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.643 -0.661 . . . . 0.0 111.09 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.461 HG23 ' CB ' ' A' ' 38' ' ' HIS . 3.6 m -127.96 -170.01 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 121.351 -0.843 . . . . 0.0 109.582 179.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -60.62 178.63 0.21 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.274 -0.891 . . . . 0.0 110.558 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -131.52 106.43 14.42 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.073 -1.017 . . . . 0.0 109.915 -179.031 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -60.08 133.98 53.45 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 C-N-CA 122.387 2.058 . . . . 0.0 111.162 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.606 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -91.01 -1.6 57.79 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.288 -0.882 . . . . 0.0 110.928 -179.83 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 3.1 p -58.07 -16.68 13.84 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.067 -1.02 . . . . 0.0 110.903 179.907 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 18.0 ttp -94.84 -5.16 45.69 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.885 -1.134 . . . . 0.0 111.036 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.48 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -81.08 168.99 18.01 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 120.549 -1.344 . . . . 0.0 110.335 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -132.85 -174.83 3.58 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.226 -0.921 . . . . 0.0 109.735 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -77.09 -17.91 58.37 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.492 -0.755 . . . . 0.0 110.481 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.48 148.76 19.62 Favored Glycine 0 N--CA 1.5 2.944 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.461 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.0 mt -53.33 110.44 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.311 -1.111 . . . . 0.0 110.091 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -47.03 123.19 5.04 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.831 -0.543 . . . . 0.0 109.955 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.58 156.44 42.43 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.005 -1.06 . . . . 0.0 110.51 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.38 -154.85 0.55 Allowed 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -62.98 87.05 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.045 -1.035 . . . . 0.0 108.615 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.412 ' CB ' " H4'" ' C' ' 125' ' ' ' DT' . 4.9 ptt180 -50.81 156.55 0.94 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.397 -0.814 . . . . 0.0 110.715 -178.743 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -49.48 135.77 17.48 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.628 -0.67 . . . . 0.0 109.794 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 22.0 m -63.83 177.13 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.429 -0.795 . . . . 0.0 109.783 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.4 p -78.08 126.16 30.41 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 0.0 109.978 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.497 1.896 0 O-C-N 121.504 -0.748 . . . . 0.0 109.812 179.902 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.543 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.908 0 C3'-C2'-C1' 106.982 3.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.543 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.441 1.622 1 O4'-C1'-N19 112.115 5.393 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.487 ' N6 ' ' N6 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.542 1 O4'-C1'-N19 111.344 4.43 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.517 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.653 1 O4'-C1'-N19 111.336 4.42 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.517 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.909 0 O4'-C1'-N19 110.563 3.454 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.892 0 O4'-C1'-N19 110.479 3.348 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.447 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.983 1 O4'-C1'-N19 111.002 4.003 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.447 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.068 0 C3'-C2'-C1' 107.078 3.127 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.637 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.87 0 O4'-C1'-N19 110.772 3.714 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.637 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.263 1 O4'-C1'-N19 111.682 4.853 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.406 ' C5 ' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.287 0 O4'-C1'-N19 110.875 3.843 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.488 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.093 0 O4'-C1'-N19 110.421 3.277 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.488 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.43 0 O4'-C1'-N19 110.446 3.308 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.601 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.982 1 O4'-C1'-N19 112.087 5.359 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.601 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.405 0 O4'-C1'-N19 110.391 3.238 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.474 ' C6 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.516 1 O4'-C1'-N19 111.055 4.069 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 12.8 pttt . . . . . 0 N--CA 1.499 1.988 0 CA-C-O 120.932 0.396 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -80.06 71.93 6.82 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.534 -1.354 . . . . 0.0 110.268 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.38 143.09 56.38 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.398 -0.814 . . . . 0.0 109.343 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.6 -35.48 4.98 Favored Glycine 0 N--CA 1.498 2.791 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.448 HG22 ' CB ' ' A' ' 26' ' ' PRO . 58.8 m -72.13 93.17 1.4 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.341 -1.093 . . . . 0.0 109.21 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.2 m -86.19 130.16 37.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.51 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 42.6 t -61.31 115.3 3.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.118 -0.988 . . . . 0.0 110.564 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.2 m -62.02 -12.73 20.27 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.416 -0.803 . . . . 0.0 110.864 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.436 ' ND2' HG11 ' A' ' 27' ' ' VAL . 57.2 m-20 -101.59 -30.14 11.55 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.068 -1.02 . . . . 0.0 110.989 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.483 ' SG ' ' CZ ' ' A' ' 47' ' ' ARG . 14.5 p -141.51 26.06 1.98 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.625 -1.297 . . . . 0.0 111.336 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 12.4 mt-30 41.82 20.93 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.613 0 O-C-N 121.307 -0.871 . . . . 0.0 113.163 178.726 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.435 ' CG2' ' SG ' ' A' ' 10' ' ' CYS . 7.3 t -85.64 132.96 34.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.411 -1.431 . . . . 0.0 109.945 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.0 t -90.66 -30.41 17.16 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.534 -0.729 . . . . 0.0 109.313 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.5 p -89.98 131.38 35.9 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.332 -0.855 . . . . 0.0 108.861 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.422 ' CG2' ' CB ' ' A' ' 28' ' ' CYS . 19.9 p -148.74 155.8 41.49 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.055 -1.028 . . . . 0.0 110.205 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.524 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 27.2 p -75.05 -44.86 45.28 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.016 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.537 HD13 ' N7 ' ' B' ' 106' ' ' ' DA' . 9.2 mt -144.84 114.05 7.0 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.116 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.415 ' CZ2' ' O ' ' A' ' 5' ' ' THR . 15.7 m95 -65.97 103.38 0.93 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.308 -0.87 . . . . 0.0 110.273 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.481 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 3.8 tpp180 -81.35 71.36 8.34 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.478 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.43 105.07 0.47 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.287 -0.883 . . . . 0.0 109.464 -179.595 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.406 ' OG ' ' HD2' ' A' ' 22' ' ' PRO . 0.3 OUTLIER -66.88 147.76 99.0 Favored Pre-proline 0 N--CA 1.501 2.113 0 O-C-N 121.295 -0.878 . . . . 0.0 110.193 -179.394 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . 0.406 ' HD2' ' OG ' ' A' ' 21' ' ' SER . 6.2 Cg_exo -54.95 -38.06 93.14 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.586 2.191 . . . . 0.0 111.105 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -23.59 56.32 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.314 -0.867 . . . . 0.0 109.584 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.74 36.98 1.63 Allowed Glycine 0 N--CA 1.497 2.749 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -123.38 101.0 38.09 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.018 -1.283 . . . . 0.0 110.426 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.478 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 2.4 Cg_endo -65.05 91.4 0.2 Allowed 'Trans proline' 0 C--N 1.312 -1.364 0 C-N-CA 122.214 1.943 . . . . 0.0 110.096 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.51 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.6 m -109.24 127.48 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.249 -0.907 . . . . 0.0 110.04 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.422 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 9.2 p -51.55 134.1 29.68 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.666 -0.646 . . . . 0.0 109.622 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -39.88 -44.91 1.73 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.546 -0.722 . . . . 0.0 111.545 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.95 -44.17 50.46 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.475 -0.765 . . . . 0.0 110.48 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.6 m -61.59 -46.69 88.77 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.294 -0.879 . . . . 0.0 108.918 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -54.75 -38.59 64.63 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.2 mt -77.73 -60.56 2.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.422 -1.046 . . . . 0.0 109.739 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.627 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 32.9 t80 -49.52 -40.15 36.74 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.331 -0.856 . . . . 0.0 109.443 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.457 ' O ' ' N ' ' A' ' 39' ' ' GLN . 27.2 t80 -56.15 -49.37 74.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.511 -0.743 . . . . 0.0 109.44 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -32.27 69.09 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 120.869 -1.144 . . . . 0.0 110.049 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.405 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 4.8 mp -60.37 -67.87 0.35 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.194 -0.941 . . . . 0.0 110.593 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.469 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 56.3 m-70 -95.16 9.83 38.17 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.147 -0.97 . . . . 0.0 110.2 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.469 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 8.2 pt20 46.65 29.07 0.88 Allowed 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.655 -0.653 . . . . 0.0 111.29 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.6 m -141.55 165.66 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 121.315 -0.866 . . . . 0.0 109.816 179.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.79 166.94 15.67 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.194 -0.941 . . . . 0.0 109.581 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.627 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 1.2 mmt180 -147.43 150.29 36.91 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.035 -1.041 . . . . 0.0 109.801 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.48 ' HD2' ' CD ' ' A' ' 42' ' ' ARG . 6.1 Cg_exo -56.54 150.25 52.97 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 C-N-CA 122.341 2.027 . . . . 0.0 110.584 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.472 ' CB ' ' O ' ' A' ' 10' ' ' CYS . 1.2 pp -74.64 1.36 12.38 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.372 -0.83 . . . . 0.0 111.459 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.2 t -59.5 -14.76 14.01 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 120.817 -1.177 . . . . 0.0 110.766 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.3 ttt -72.81 -37.43 67.51 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.918 -1.114 . . . . 0.0 110.489 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.483 ' CZ ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -81.75 169.77 16.53 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.095 -1.003 . . . . 0.0 110.229 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -122.41 -169.9 1.98 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.125 -0.984 . . . . 0.0 110.229 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.72 -82.33 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.582 -0.699 . . . . 0.0 110.92 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -87.37 165.89 35.99 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.9 mt -54.3 136.63 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.003 -1.292 . . . . 0.0 110.109 -179.813 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -66.36 138.09 57.35 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.677 -0.639 . . . . 0.0 109.825 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.85 163.63 38.97 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.093 -1.004 . . . . 0.0 109.593 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.87 -157.42 0.81 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.507 -0.745 . . . . 0.0 109.294 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -59.67 135.14 57.59 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.968 -1.082 . . . . 0.0 109.487 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.435 ' HD2' " O3'" ' C' ' 125' ' ' ' DT' . 10.0 tpp180 -55.22 140.56 38.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.596 -0.69 . . . . 0.0 110.216 -179.431 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.5 134.1 45.12 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -52.57 132.76 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.36 -0.837 . . . . 0.0 109.142 179.5 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.7 p -50.09 139.46 14.2 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.507 -0.746 . . . . 0.0 110.194 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.826 0 O-C-N 121.671 -0.643 . . . . 0.0 110.149 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.483 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.612 1.888 0 C3'-C2'-C1' 107.158 3.184 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.561 ' N7 ' HD13 ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.442 1.696 0 O4'-C1'-N19 110.788 3.735 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.412 " O5'" H2'' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.528 2.146 1 O4'-C1'-N19 111.198 4.247 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.144 0 O4'-C1'-N19 110.855 3.819 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.496 H2'' ' C8 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.818 0 O4'-C1'-N19 110.581 3.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.496 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.95 0 O4'-C1'-N19 110.56 3.45 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.009 0 O4'-C1'-N19 110.966 3.958 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.981 0 O4'-C1'-N19 110.517 3.396 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.653 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.685 0 O4'-C1'-N19 110.887 3.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.653 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.476 1 O4'-C1'-N19 111.706 4.882 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.458 1 O4'-C1'-N19 111.099 4.123 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.459 ' OP2' ' HB2' ' A' ' 34' ' ' TYR . . . . . . . . 0 C5'--C4' 1.528 2.088 0 C3'-C2'-C1' 107.096 3.14 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.5 " H3'" ' CG2' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.695 0 O4'-C1'-N19 110.374 3.217 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.659 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.296 1 O4'-C1'-N19 112.745 6.181 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.659 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.412 0 O4'-C1'-N19 110.795 3.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.438 ' OP1' ' HB2' ' A' ' 59' ' ' SER . . . . . . . . 0 C5'--C4' 1.525 1.81 0 O4'-C1'-N19 110.596 3.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.9 tptt . . . . . 0 N--CA 1.499 1.996 0 CA-C-O 121.25 0.548 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -81.64 -26.66 34.6 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.038 -1.039 . . . . 0.0 109.528 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.79 150.16 29.0 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.167 -0.958 . . . . 0.0 108.839 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 95.74 -30.14 8.83 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.348 -1.501 . . . . 0.0 109.348 -178.977 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.483 HG21 ' HB2' ' A' ' 26' ' ' PRO . 11.2 m -58.31 93.46 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.231 -1.158 . . . . 0.0 109.063 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 13.7 m -85.28 140.16 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.133 -0.979 . . . . 0.0 108.794 -179.735 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.645 ' HB2' HG23 ' A' ' 12' ' ' THR . 31.4 t -64.67 120.36 12.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.161 -0.962 . . . . 0.0 110.252 -179.379 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 m -63.23 -14.03 44.63 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.392 -0.817 . . . . 0.0 110.427 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.405 ' ND2' HG11 ' A' ' 27' ' ' VAL . 69.9 m-20 -107.64 -17.18 14.16 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.996 -1.065 . . . . 0.0 111.146 -179.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.499 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 8.4 p -154.01 24.31 0.5 Allowed 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.565 -1.335 . . . . 0.0 111.116 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.437 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 7.7 pt20 33.73 34.41 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.605 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 178.718 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.645 HG23 ' HB2' ' A' ' 7' ' ' CYS . 6.1 t -83.79 131.33 34.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.541 -1.349 . . . . 0.0 109.165 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.3 p -89.28 -1.1 57.94 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.315 -0.865 . . . . 0.0 109.18 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.5 p -128.35 132.25 48.59 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.489 -0.757 . . . . 0.0 109.241 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.537 HG21 ' CZ2' ' A' ' 18' ' ' TRP . 5.7 p -144.9 158.77 43.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.306 -0.871 . . . . 0.0 109.543 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.621 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 48.8 p -85.95 -26.99 25.21 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.641 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 59.9 mt -146.48 94.62 2.47 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.537 ' CZ2' HG21 ' A' ' 15' ' ' THR . 9.7 m95 -57.8 115.6 2.92 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.969 -1.082 . . . . 0.0 110.395 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.27 92.61 4.28 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.314 -0.866 . . . . 0.0 109.289 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -80.47 104.87 11.3 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.0 109.239 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.4 m -64.05 148.11 95.7 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.145 -0.972 . . . . 0.0 110.123 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -55.37 -44.92 44.13 Favored 'Trans proline' 0 C--N 1.319 -1.016 0 C-N-CA 122.771 2.314 . . . . 0.0 111.191 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 41.2 mtt -57.76 -21.54 41.96 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.236 -0.915 . . . . 0.0 110.153 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.429 ' HA2' ' NH1' ' A' ' 20' ' ' ARG . . . 111.04 45.36 0.88 Allowed Glycine 0 N--CA 1.497 2.716 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -128.34 92.68 40.54 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.572 -0.958 . . . . 0.0 110.172 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.484 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.7 Cg_endo -63.47 95.63 0.18 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.08 1.854 . . . . 0.0 109.728 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.532 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.04 124.22 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.099 -1.0 . . . . 0.0 110.617 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.472 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.3 p -49.17 136.15 15.56 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.653 -0.654 . . . . 0.0 109.867 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.641 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 12.2 t-20 -40.2 -41.08 1.23 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.661 -0.65 . . . . 0.0 111.465 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.83 -45.81 59.74 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.372 -0.83 . . . . 0.0 110.265 179.883 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.433 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 34.6 m -67.92 -39.83 83.47 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.288 -0.882 . . . . 0.0 108.751 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.95 -39.21 95.28 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 65.0 mt -74.72 -60.74 2.14 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.415 -1.05 . . . . 0.0 109.881 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.542 ' CE1' ' HB3' ' A' ' 42' ' ' ARG . 47.3 t80 -49.22 -37.84 24.4 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.378 -0.826 . . . . 0.0 109.106 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.537 ' O ' ' N ' ' A' ' 39' ' ' GLN . 15.9 t80 -62.08 -52.88 62.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.543 -0.723 . . . . 0.0 109.659 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.42 -29.13 14.84 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.651 -1.28 . . . . 0.0 110.434 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.32 -63.39 1.07 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.027 -1.046 . . . . 0.0 110.862 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.454 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 9.7 m-70 -97.42 -32.44 11.85 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.126 -0.984 . . . . 0.0 110.214 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.537 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 81.87 26.73 0.18 Allowed 'General case' 0 N--CA 1.504 2.265 0 CA-C-O 121.699 0.761 . . . . 0.0 110.689 -179.853 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.6 m -130.63 168.18 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 O-C-N 120.857 -1.152 . . . . 0.0 109.754 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -73.32 146.82 44.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.21 -0.931 . . . . 0.0 109.18 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.542 ' HB3' ' CE1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -128.5 149.94 73.12 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.069 -1.02 . . . . 0.0 110.456 -179.346 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.402 ' O ' ' HD3' ' A' ' 42' ' ' ARG . 2.1 Cg_endo -62.33 135.67 55.28 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 C-N-CA 122.506 2.137 . . . . 0.0 111.091 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.499 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -84.54 29.54 0.59 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.367 -0.833 . . . . 0.0 111.063 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.0 t -61.21 -17.4 53.03 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.751 -1.218 . . . . 0.0 110.473 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.51 -7.53 57.48 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.899 -1.126 . . . . 0.0 110.608 179.284 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.453 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -73.34 113.52 10.51 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.61 -1.307 . . . . 0.0 109.251 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.84 -156.25 0.57 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.474 -0.767 . . . . 0.0 110.172 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -73.91 0.12 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.472 -0.768 . . . . 0.0 110.328 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -102.84 174.04 23.11 Favored Glycine 0 N--CA 1.497 2.715 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.425 HG22 HG22 ' A' ' 16' ' ' THR . 6.1 mt -59.02 135.26 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.279 -1.13 . . . . 0.0 110.005 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -69.84 161.6 29.57 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.448 -0.782 . . . . 0.0 110.133 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.51 168.75 26.42 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.38 -0.825 . . . . 0.0 109.048 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.89 -169.37 3.36 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.259 -0.9 . . . . 0.0 109.203 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -56.17 100.13 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.947 -1.096 . . . . 0.0 108.704 179.144 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -46.43 127.15 8.88 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.572 -0.705 . . . . 0.0 110.7 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -63.13 125.16 23.14 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.72 -0.612 . . . . 0.0 110.061 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 47.2 t -74.87 158.34 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.475 -0.766 . . . . 0.0 109.678 179.931 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.438 ' HB2' ' OP1' ' C' ' 127' ' ' ' DT' . 48.2 t -72.75 76.58 1.12 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.155 -0.966 . . . . 0.0 109.886 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 N--CA 1.493 1.724 0 O-C-N 121.359 -0.838 . . . . 0.0 109.189 179.86 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.552 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.443 1.752 0 C3'-C2'-C1' 107.027 3.09 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.552 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.871 1 O4'-C1'-N19 111.988 5.235 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.637 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.471 1 O4'-C1'-N19 111.31 4.387 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.637 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.06 1 O4'-C1'-N19 111.122 4.153 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.538 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.704 0 O4'-C1'-N19 110.81 3.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.758 0 O4'-C1'-N19 110.504 3.38 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.865 0 O4'-C1'-N19 110.915 3.894 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.049 0 O4'-C1'-N19 110.427 3.284 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.631 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.903 1 O4'-C1'-N19 111.263 4.329 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.631 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.424 1 O4'-C1'-N19 112.287 5.608 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.417 ' C4 ' ' N3 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.527 1 O4'-C1'-N19 112.1 5.375 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.43 H2'' " O5'" ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.877 0 O4'-C1'-N19 110.664 3.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.518 " H3'" ' CG2' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.528 2.156 0 O4'-C1'-N19 110.606 3.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.599 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.314 1 O4'-C1'-N19 112.144 5.43 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.46 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.702 0 O4'-C1'-N19 110.946 3.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.438 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.486 1 O4'-C1'-N19 111.041 4.051 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.832 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 mmt180 -100.5 43.05 1.08 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.333 -0.855 . . . . 0.0 109.452 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.28 135.88 57.23 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.29 -0.881 . . . . 0.0 109.974 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.98 0.86 65.69 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.441 HG23 ' CH2' ' A' ' 18' ' ' TRP . 53.5 m -81.46 84.92 6.57 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.862 -1.375 . . . . 0.0 109.976 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.9 m -85.23 114.69 25.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 178.658 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.657 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 1.7 t -42.61 113.22 0.44 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.45 -0.781 . . . . 0.0 110.932 -178.135 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' SER . . . . . 0.538 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 53.5 m -65.51 -12.58 54.09 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.134 -0.979 . . . . 0.0 111.276 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -103.38 -24.84 13.46 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.955 -1.09 . . . . 0.0 110.583 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.495 ' SG ' ' HD3' ' A' ' 47' ' ' ARG . 9.2 p -144.7 25.83 1.44 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.88 -1.137 . . . . 0.0 110.767 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.498 ' HB2' ' CD2' ' A' ' 44' ' ' LEU . 0.0 OUTLIER 38.96 25.6 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.367 -0.833 . . . . 0.0 113.028 178.781 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.532 HG23 ' HB2' ' A' ' 7' ' ' CYS . 5.4 t -89.08 131.2 35.34 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.412 -1.43 . . . . 0.0 109.218 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.2 p -90.03 -29.82 18.15 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.484 ' HB ' ' CG1' ' A' ' 51' ' ' ILE . 2.9 p -93.79 124.8 38.03 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.419 -0.801 . . . . 0.0 109.438 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.454 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 11.9 p -134.01 140.15 46.51 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.35 -0.844 . . . . 0.0 109.244 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.599 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 70.4 p -62.14 -36.86 83.07 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 179.076 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.509 HD13 ' N7 ' ' B' ' 106' ' ' ' DA' . 13.2 mt -149.56 112.28 4.79 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.454 ' CZ2' HG23 ' A' ' 15' ' ' THR . 13.8 m95 -59.58 123.44 16.9 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.495 -0.753 . . . . 0.0 110.112 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.473 ' O ' HG23 ' A' ' 27' ' ' VAL . 2.0 ttm180 -116.34 74.47 0.9 Allowed 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.73 119.5 11.31 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.939 -1.101 . . . . 0.0 109.503 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -86.91 142.62 34.28 Favored Pre-proline 0 N--CA 1.501 2.085 0 O-C-N 121.016 -1.053 . . . . 0.0 110.006 -179.67 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -56.27 -28.67 72.7 Favored 'Trans proline' 0 C--N 1.32 -0.946 0 C-N-CA 122.722 2.281 . . . . 0.0 110.981 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.5 mtp -55.45 -25.11 34.62 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.469 -0.77 . . . . 0.0 109.63 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.14 35.31 2.55 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.657 -1.377 . . . . 0.0 109.657 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -137.8 108.38 8.4 Favored Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 121.381 -1.07 . . . . 0.0 109.966 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.538 ' HD2' ' OG ' ' A' ' 8' ' ' SER . 2.9 Cg_endo -60.7 99.7 0.15 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 C-N-CA 121.786 1.657 . . . . 0.0 110.087 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.657 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.1 m -109.97 147.51 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.173 -0.954 . . . . 0.0 109.745 179.721 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.448 ' N ' ' SG ' ' A' ' 7' ' ' CYS . 30.4 p -83.5 153.65 24.3 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.286 -0.884 . . . . 0.0 108.656 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.402 ' C ' ' O ' ' A' ' 28' ' ' CYS . 11.2 t-20 -41.36 -42.56 2.27 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.562 -0.712 . . . . 0.0 110.079 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.67 -43.46 97.62 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.32 -0.863 . . . . 0.0 110.794 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.499 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 1.7 m -58.97 -44.21 91.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.099 -1.001 . . . . 0.0 108.924 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -68.82 -38.78 85.69 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.496 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 36.3 mt -69.5 -66.07 0.63 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.373 -1.075 . . . . 0.0 110.609 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 80.2 t80 -49.91 -35.29 23.24 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.98 -1.075 . . . . 0.0 109.57 -179.812 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.574 ' CE1' ' HG3' ' A' ' 39' ' ' GLN . 29.4 t80 -61.76 -47.7 84.0 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.338 -0.851 . . . . 0.0 109.838 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.496 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -57.51 -24.36 55.52 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 120.038 -1.664 . . . . 0.0 110.633 179.528 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.454 HD13 ' O ' ' A' ' 33' ' ' LEU . 2.3 mp -70.78 -67.55 0.5 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.999 -1.063 . . . . 0.0 110.189 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 12.8 m-70 -97.29 -22.12 16.85 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.198 -0.939 . . . . 0.0 110.147 -179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.574 ' HG3' ' CE1' ' A' ' 35' ' ' TYR . 1.1 tt0 65.27 48.75 2.08 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 121.913 0.863 . . . . 0.0 110.438 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -142.21 169.54 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 O-C-N 121.294 -0.879 . . . . 0.0 109.012 179.225 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.4 p-10 -83.92 150.57 25.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.992 -1.067 . . . . 0.0 108.852 179.299 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.492 ' CG ' ' HD2' ' A' ' 43' ' ' PRO . 64.4 ttt180 -145.08 137.99 13.83 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 120.818 -1.176 . . . . 0.0 110.236 -179.407 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.492 ' HD2' ' CG ' ' A' ' 42' ' ' ARG . 3.3 Cg_exo -59.94 151.18 73.58 Favored 'Trans proline' 0 C--N 1.317 -1.126 0 C-N-CA 122.462 2.108 . . . . 0.0 110.415 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.498 ' CD2' ' HB2' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -83.14 40.52 0.71 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.06 -1.025 . . . . 0.0 111.144 -179.395 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.4 p -70.78 -10.13 58.86 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.913 -1.117 . . . . 0.0 110.309 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.0 ttm -102.3 -19.42 15.02 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.035 -1.041 . . . . 0.0 110.765 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.495 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 1.9 mpt_? -81.64 175.24 10.64 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.856 -1.153 . . . . 0.0 110.171 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.7 166.09 29.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.31 -0.868 . . . . 0.0 109.696 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -58.07 -28.25 64.37 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.309 -0.869 . . . . 0.0 110.342 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -109.17 123.39 6.88 Favored Glycine 0 N--CA 1.497 2.722 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.484 ' CG1' ' HB ' ' A' ' 14' ' ' THR . 5.5 mt -53.37 136.6 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.418 -1.048 . . . . 0.0 110.075 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.81 146.27 40.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.505 -0.747 . . . . 0.0 110.001 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.25 158.82 39.44 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.117 -0.989 . . . . 0.0 109.433 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -151.31 -162.39 1.53 Allowed 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -54.13 103.63 0.09 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.841 -1.162 . . . . 0.0 108.921 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -55.73 160.99 2.32 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.55 -0.719 . . . . 0.0 110.672 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm -66.04 128.14 34.89 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.473 -0.767 . . . . 0.0 110.045 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 1.7 m -70.96 172.2 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.477 -0.764 . . . . 0.0 109.325 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.2 p -82.65 119.38 24.22 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.948 -1.095 . . . . 0.0 108.808 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 N--CA 1.497 1.9 0 O-C-N 121.107 -0.996 . . . . 0.0 109.743 -179.257 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.55 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.612 1.874 0 C3'-C2'-C1' 106.918 3.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.55 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.439 1.454 1 O4'-C1'-N19 111.878 5.097 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.634 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.213 0 O4'-C1'-N19 110.977 3.971 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.634 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.932 1 O4'-C1'-N19 111.302 4.377 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.585 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.67 0 O4'-C1'-N19 110.723 3.654 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.477 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.703 0 O4'-C1'-N19 110.925 3.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.477 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.726 1 O4'-C1'-N19 111.148 4.186 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.402 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.832 0 O4'-C1'-N19 110.552 3.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.702 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.523 1.543 1 O4'-C1'-N19 111.894 5.118 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.702 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.533 2.743 1 O4'-C1'-N19 111.639 4.799 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.47 ' N3 ' ' N1 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.099 1 O4'-C1'-N19 111.521 4.651 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.49 ' OP2' ' HB2' ' A' ' 34' ' ' TYR . . . . . . . . 0 C5'--C4' 1.53 2.343 0 O4'-C1'-N19 110.627 3.534 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.503 " C5'" ' HG2' ' A' ' 52' ' ' GLN . . . . . . . . 0 C5'--C4' 1.532 2.587 0 O4'-C1'-N19 110.591 3.489 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.542 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.502 1 O4'-C1'-N19 112.271 5.588 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.526 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.806 0 O4'-C1'-N19 110.58 3.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.49 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.195 0 O4'-C1'-N19 110.841 3.801 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt . . . . . 0 N--CA 1.496 1.831 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -77.19 -1.51 29.8 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.265 -0.897 . . . . 0.0 110.121 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -53.05 153.83 3.3 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.036 -1.04 . . . . 0.0 109.447 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.21 -28.61 13.12 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 108.944 -1.662 . . . . 0.0 108.944 -178.768 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.473 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 27.8 m -60.13 92.16 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.409 -1.054 . . . . 0.0 109.524 179.302 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 35.3 m -93.33 119.0 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 179.741 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.547 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 9.3 t -46.8 114.93 0.92 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.454 -0.778 . . . . 0.0 110.809 -178.482 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.4 m -63.13 -14.62 50.76 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.231 -0.918 . . . . 0.0 110.03 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -98.7 -29.16 13.18 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.103 -0.998 . . . . 0.0 110.918 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.584 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 10.4 p -143.16 25.79 1.71 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.649 -1.282 . . . . 0.0 111.456 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.415 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER 37.15 35.54 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.592 -0.693 . . . . 0.0 112.76 178.866 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.536 ' O ' HG21 ' A' ' 12' ' ' THR . 9.5 t -88.27 138.27 31.59 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.704 -1.248 . . . . 0.0 109.464 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.3 p -101.13 -19.79 15.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.344 -0.848 . . . . 0.0 109.627 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.413 ' HB ' HG13 ' A' ' 51' ' ' ILE . 12.0 p -108.97 113.08 25.65 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.512 -0.743 . . . . 0.0 109.537 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.524 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 4.8 p -132.83 147.41 52.3 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.212 -0.93 . . . . 0.0 110.143 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.542 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 29.9 p -73.57 -28.06 61.65 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.482 ' CD2' ' N7 ' ' B' ' 106' ' ' ' DA' . 18.8 mt -149.81 120.24 7.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.515 -0.741 . . . . 0.0 109.196 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.524 ' CZ2' HG23 ' A' ' 15' ' ' THR . 8.5 m95 -84.68 117.97 24.11 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.427 -0.796 . . . . 0.0 109.796 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.538 ' HD2' ' HA ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -108.7 103.36 12.44 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.156 -0.965 . . . . 0.0 109.14 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 2.0 mmt180 -77.33 119.61 21.21 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.326 -0.859 . . . . 0.0 109.729 -179.495 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 55.7 m -75.33 149.75 84.57 Favored Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.334 -0.854 . . . . 0.0 110.113 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -53.66 -47.76 25.51 Favored 'Trans proline' 0 C--N 1.321 -0.9 0 C-N-CA 122.793 2.328 . . . . 0.0 111.147 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 7.6 ttt -55.71 -25.55 40.68 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.291 -0.881 . . . . 0.0 109.435 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 114.49 45.62 0.66 Allowed Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -132.11 102.98 14.24 Favored Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.288 -1.125 . . . . 0.0 111.026 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.473 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 2.5 Cg_endo -65.42 105.14 0.7 Allowed 'Trans proline' 0 C--N 1.315 -1.231 0 C-N-CA 122.323 2.015 . . . . 0.0 109.7 178.279 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.547 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -116.45 126.69 74.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.317 -0.864 . . . . 0.0 110.736 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.434 ' HB3' ' CG2' ' A' ' 12' ' ' THR . 8.1 p -49.92 139.91 12.89 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.648 -0.658 . . . . 0.0 109.787 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.538 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 18.2 t-20 -43.13 -46.71 5.95 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.357 -0.839 . . . . 0.0 112.218 -178.39 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -46.43 -45.97 18.44 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.346 -0.846 . . . . 0.0 110.615 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.508 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 9.9 m -63.23 -44.92 93.9 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.682 -0.636 . . . . 0.0 109.37 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.47 -49.36 77.94 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.413 HD12 ' H62' ' C' ' 124' ' ' ' DA' . 42.2 mt -67.04 -60.6 2.49 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.473 -1.016 . . . . 0.0 109.938 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.49 ' HB2' ' OP2' ' C' ' 123' ' ' ' DT' . 50.6 t80 -51.41 -43.24 61.93 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.567 -0.708 . . . . 0.0 109.619 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.508 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 47.6 t80 -53.38 -47.33 69.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.411 -0.806 . . . . 0.0 108.866 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -43.09 99.58 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.057 -1.027 . . . . 0.0 110.358 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.412 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 9.6 mp -40.86 -56.62 2.17 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 121.506 -0.747 . . . . 0.0 110.705 -179.175 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.442 ' HB2' ' CG2' ' A' ' 40' ' ' VAL . 41.2 m-70 -115.1 6.46 15.17 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.171 -0.956 . . . . 0.0 110.288 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 35' ' ' TYR . 1.7 tm0? 49.36 34.71 6.77 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.397 -0.815 . . . . 0.0 110.13 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.442 ' CG2' ' HB2' ' A' ' 38' ' ' HIS . 3.7 m -141.05 167.14 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 O-C-N 121.121 -0.987 . . . . 0.0 110.17 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -84.53 156.35 21.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.505 -0.747 . . . . 0.0 109.747 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.489 ' CG ' ' HD2' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -151.08 152.07 30.7 Favored Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.296 -0.878 . . . . 0.0 109.545 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.489 ' HD2' ' CG ' ' A' ' 42' ' ' ARG . 4.6 Cg_exo -55.41 143.78 75.63 Favored 'Trans proline' 0 C--N 1.316 -1.174 0 C-N-CA 122.313 2.009 . . . . 0.0 111.147 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.584 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -95.46 37.71 1.18 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.464 -0.773 . . . . 0.0 110.561 -179.582 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -70.57 -6.64 37.97 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.946 -1.096 . . . . 0.0 110.038 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 38.1 mtp -92.15 -16.0 26.89 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.979 -1.075 . . . . 0.0 110.303 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.555 ' HG2' ' HB2' ' A' ' 44' ' ' LEU . 25.3 mmm180 -56.43 151.28 13.49 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.728 -1.232 . . . . 0.0 109.591 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -139.53 155.35 47.57 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.447 -0.783 . . . . 0.0 109.871 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -49.67 -77.59 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.616 -0.678 . . . . 0.0 110.49 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -83.4 148.4 25.16 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.456 HD11 ' N ' ' A' ' 16' ' ' THR . 10.1 mt -54.25 136.89 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.324 -1.104 . . . . 0.0 109.773 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.503 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -75.48 156.0 35.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.552 -0.718 . . . . 0.0 109.836 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.429 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.99 163.01 40.24 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.439 -0.788 . . . . 0.0 109.045 178.835 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.406 ' HA ' ' HD3' ' A' ' 54' ' ' ARG . 15.6 mmt180 -147.67 -165.81 2.36 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -57.35 111.0 0.95 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.823 -1.173 . . . . 0.0 108.863 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -46.21 128.3 9.48 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.332 -0.855 . . . . 0.0 111.111 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt -63.01 117.58 6.64 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.637 -0.664 . . . . 0.0 109.322 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.4 m -71.14 178.4 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.447 -0.783 . . . . 0.0 109.868 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.0 t -83.48 139.56 32.85 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.028 -1.045 . . . . 0.0 109.717 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.796 0 O-C-N 121.527 -0.733 . . . . 0.0 110.304 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.588 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.524 1.656 0 O4'-C1'-N19 110.427 3.284 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.588 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.44 1.529 1 O4'-C1'-N19 111.403 4.504 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.541 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.123 0 O4'-C1'-N19 110.783 3.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.541 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 P--O5' 1.611 1.767 1 O4'-C1'-N19 111.002 4.002 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.541 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.836 0 O4'-C1'-N19 110.868 3.835 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.436 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.868 0 C3'-C2'-C1' 107.106 3.147 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.901 0 O4'-C1'-N19 110.992 3.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.154 0 O4'-C1'-N19 110.589 3.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.661 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.441 1.644 1 O4'-C1'-N19 111.139 4.174 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.661 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.322 1 O4'-C1'-N19 112.061 5.326 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.442 ' C4 ' ' N3 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.496 1 O4'-C1'-N19 111.705 4.881 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.404 H2'' " O5'" ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.288 0 O4'-C1'-N19 110.303 3.128 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.485 " H3'" ' CG2' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.507 0 O4'-C1'-N19 110.224 3.03 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.624 " O3'" ' HD3' ' A' ' 56' ' ' ARG . . . . . . . . 0 C5'--C4' 1.526 1.849 1 O4'-C1'-N19 112.333 5.666 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.571 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.114 0 O4'-C1'-N19 110.641 3.551 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.479 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.508 1 O4'-C1'-N19 111.015 4.018 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.965 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.39 29.92 1.84 Allowed 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.27 -0.894 . . . . 0.0 109.712 179.514 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.92 130.54 47.5 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.235 -0.915 . . . . 0.0 109.303 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.91 -37.9 2.08 Favored Glycine 0 N--CA 1.495 2.625 0 N-CA-C 108.909 -1.676 . . . . 0.0 108.909 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.417 ' O ' ' CH2' ' A' ' 18' ' ' TRP . 65.8 m -66.53 89.08 0.14 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.362 -1.081 . . . . 0.0 109.264 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 28.7 m -85.15 109.72 18.48 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 179.526 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.529 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 53.9 t -45.17 113.55 0.59 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.338 -0.851 . . . . 0.0 110.266 -178.778 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.4 m -63.23 -6.78 4.81 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.366 -0.833 . . . . 0.0 111.285 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.6 m120 -102.9 -31.01 10.47 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.795 -1.19 . . . . 0.0 110.728 -179.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.61 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 17.7 p -138.19 18.84 2.78 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.812 -1.18 . . . . 0.0 111.003 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.82 25.51 0.46 Allowed 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.351 -0.843 . . . . 0.0 111.615 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.464 HG22 ' CB ' ' A' ' 7' ' ' CYS . 5.8 t -88.6 132.53 34.5 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.67 -1.268 . . . . 0.0 109.525 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 p -92.68 -6.66 48.77 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.592 -0.693 . . . . 0.0 109.25 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.0 p -112.69 128.86 56.52 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.33 -0.856 . . . . 0.0 109.686 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.553 HG22 ' CZ2' ' A' ' 18' ' ' TRP . 5.4 p -149.07 152.56 36.42 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.059 -1.025 . . . . 0.0 109.883 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.582 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 19.5 p -83.65 -31.06 26.38 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.6 -0.687 . . . . 0.0 109.461 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.631 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 24.9 mt -141.48 87.4 2.07 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.392 -0.818 . . . . 0.0 108.873 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.553 ' CZ2' HG22 ' A' ' 15' ' ' THR . 11.5 m95 -53.32 103.14 0.07 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.247 -0.908 . . . . 0.0 110.357 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.495 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 2.3 tpt180 -88.61 83.94 6.75 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.35 -0.844 . . . . 0.0 109.259 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.447 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.8 tpp180 -71.44 114.64 9.72 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.299 -0.876 . . . . 0.0 108.903 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 26.4 p -84.01 139.6 39.85 Favored Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.178 -0.951 . . . . 0.0 109.573 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -55.86 -31.79 82.51 Favored 'Trans proline' 0 C--N 1.319 -1.011 0 C-N-CA 122.589 2.193 . . . . 0.0 111.053 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -23.81 44.88 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.436 -0.79 . . . . 0.0 109.343 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.11 28.19 3.95 Favored Glycine 0 N--CA 1.496 2.664 0 N-CA-C 109.994 -1.242 . . . . 0.0 109.994 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -129.47 99.79 20.65 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.052 -1.263 . . . . 0.0 110.14 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.457 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 Cg_endo -66.09 108.04 1.25 Allowed 'Trans proline' 0 C--N 1.314 -1.278 0 C-N-CA 122.216 1.944 . . . . 0.0 109.818 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.529 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.8 m -121.12 125.9 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.109 -0.994 . . . . 0.0 110.351 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.509 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.9 p -51.4 131.84 29.04 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.56 -0.713 . . . . 0.0 109.514 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.631 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 6.0 t-20 -41.97 -40.37 2.17 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.486 -0.759 . . . . 0.0 111.725 -178.287 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.35 -38.43 53.14 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.113 -0.992 . . . . 0.0 109.79 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.56 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 2.3 m -68.06 -42.22 80.8 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.65 -57.04 17.92 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 30.4 mt -59.71 -42.88 94.06 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.512 -0.993 . . . . 0.0 109.006 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -57.95 -42.58 85.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.353 -0.842 . . . . 0.0 109.268 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.558 ' HB2' ' NE ' ' A' ' 42' ' ' ARG . 41.4 t80 -55.79 -36.3 67.24 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.305 -0.872 . . . . 0.0 110.169 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -79.29 -49.93 11.69 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.75 -1.219 . . . . 0.0 110.092 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -49.34 -33.01 12.4 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.326 -0.859 . . . . 0.0 110.219 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 16.3 m-70 -118.3 -6.18 10.82 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.137 -0.977 . . . . 0.0 110.64 -179.983 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.47 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.4 OUTLIER 50.07 34.88 8.9 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.096 -1.002 . . . . 0.0 109.937 -179.295 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.417 ' O ' ' CD2' ' A' ' 35' ' ' TYR . 3.4 m -138.71 -169.11 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 O-C-N 121.271 -0.893 . . . . 0.0 109.383 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -176.02 0.05 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.27 -0.894 . . . . 0.0 109.771 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.56 ' HG2' ' O ' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -135.63 86.26 28.87 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.011 -1.056 . . . . 0.0 110.047 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -64.79 147.26 89.52 Favored 'Trans proline' 0 C--N 1.314 -1.279 0 C-N-CA 122.367 2.045 . . . . 0.0 110.46 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.61 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -91.34 12.78 19.32 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.093 -1.004 . . . . 0.0 110.523 179.661 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 p -53.96 -26.12 24.14 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 120.955 -1.091 . . . . 0.0 110.611 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 8.1 ttp -94.61 -6.65 43.0 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.197 -0.939 . . . . 0.0 110.845 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.457 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -81.47 162.4 23.29 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.931 -1.105 . . . . 0.0 110.395 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.518 ' HD2' ' HG3' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -146.18 -173.56 4.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.525 -0.734 . . . . 0.0 109.118 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.71 -9.05 58.18 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.383 -0.823 . . . . 0.0 111.598 -179.315 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -141.53 149.74 21.34 Favored Glycine 0 N--CA 1.501 3.026 0 O-C-N 120.53 -1.356 . . . . 0.0 110.727 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.7 mt -63.6 131.76 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.379 -1.071 . . . . 0.0 109.567 179.648 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.518 ' HG3' ' HD2' ' A' ' 48' ' ' LYS . 3.6 mt-30 -63.73 136.85 57.77 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.335 -0.853 . . . . 0.0 110.145 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.61 160.67 40.63 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.102 -0.999 . . . . 0.0 109.853 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.51 -155.67 0.63 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -56.39 114.96 2.22 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.835 -1.165 . . . . 0.0 108.503 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.624 ' HD3' " O3'" ' C' ' 125' ' ' ' DT' . 5.3 ttm180 -51.78 143.13 13.59 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.508 -0.745 . . . . 0.0 110.773 -178.757 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -58.22 143.33 44.67 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.503 -0.748 . . . . 0.0 109.529 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.4 p -50.43 116.25 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 N-CA-C 108.847 -0.798 . . . . 0.0 108.847 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.37 104.38 0.11 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.438 -0.788 . . . . 0.0 109.715 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.497 1.92 0 O-C-N 121.503 -0.748 . . . . 0.0 110.022 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.543 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.02 0 C3'-C2'-C1' 106.974 3.053 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.543 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.945 1 O4'-C1'-N19 112.116 5.395 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.636 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.451 1 O4'-C1'-N19 111.22 4.276 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.636 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.001 1 O4'-C1'-N19 111.2 4.25 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.538 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.79 0 O4'-C1'-N19 110.585 3.481 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C1'-N19 110.542 3.428 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.432 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.44 1.556 1 O4'-C1'-N19 111.219 4.273 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.432 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.782 0 O4'-C1'-N19 110.452 3.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.577 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.808 0 O4'-C1'-N19 110.599 3.499 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.577 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.579 1 O4'-C1'-N19 111.634 4.793 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.422 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.49 0 O4'-C1'-N19 110.931 3.914 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.432 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.3 0 O4'-C1'-N19 110.845 3.806 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.456 " H3'" ' CG2' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.708 1 O4'-C1'-N19 111.053 4.066 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.57 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.529 2.312 1 O4'-C1'-N19 111.815 5.018 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.491 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.465 0 O4'-C1'-N19 110.69 3.613 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.432 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.481 0 O4'-C1'-N19 110.579 3.474 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.799 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.09 66.76 9.48 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.176 -0.953 . . . . 0.0 109.018 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.22 146.56 43.18 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.326 -0.859 . . . . 0.0 109.544 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.27 -31.93 8.16 Favored Glycine 0 N--CA 1.495 2.584 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.496 HG21 ' CB ' ' A' ' 26' ' ' PRO . 55.1 m -66.59 93.97 0.27 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.284 -1.127 . . . . 0.0 109.917 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.6 m -100.14 138.73 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.494 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 12.2 t -58.18 118.79 5.85 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.256 -0.902 . . . . 0.0 110.478 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.2 m -64.11 -12.75 42.36 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.245 -0.909 . . . . 0.0 110.153 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -105.04 -25.46 12.53 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.183 -0.948 . . . . 0.0 110.855 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.552 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 7.5 p -147.9 28.05 0.95 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.657 -1.277 . . . . 0.0 111.12 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 30.69 40.56 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.688 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 178.676 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.609 ' HB ' ' HD3' ' A' ' 47' ' ' ARG . 12.2 t -90.44 139.7 30.43 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.976 -1.077 . . . . 0.0 108.96 178.833 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -99.0 -24.97 14.72 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.946 -1.096 . . . . 0.0 109.493 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.8 p -101.25 116.06 31.93 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.494 -0.754 . . . . 0.0 109.232 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.516 HG21 HG22 ' A' ' 12' ' ' THR . 6.2 p -138.49 154.93 48.82 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.028 -1.045 . . . . 0.0 110.037 -179.597 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.57 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 40.9 p -74.87 -31.33 61.59 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.149 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.442 ' CD1' ' O6 ' ' B' ' 107' ' ' ' DG' . 8.8 mt -153.94 125.01 7.32 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -82.04 106.51 14.01 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.628 -0.67 . . . . 0.0 109.979 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.537 ' HB2' ' O ' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -80.91 77.45 7.79 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.071 -1.018 . . . . 0.0 108.985 179.43 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.457 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 18.3 tpt180 -61.29 99.62 0.11 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.546 ' HB3' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -60.21 152.03 64.61 Favored Pre-proline 0 N--CA 1.5 2.026 0 O-C-N 121.395 -0.816 . . . . 0.0 109.545 -179.421 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -54.17 -44.21 51.4 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 C-N-CA 122.645 2.23 . . . . 0.0 110.809 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -19.08 64.95 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.255 -0.903 . . . . 0.0 109.731 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.02 41.63 1.16 Allowed Glycine 0 N--CA 1.496 2.678 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.546 ' HB2' ' HB3' ' A' ' 21' ' ' SER . 51.1 m-20 -120.02 96.25 49.32 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.274 -1.133 . . . . 0.0 110.196 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.496 ' CB ' HG21 ' A' ' 5' ' ' THR . 1.3 Cg_endo -68.22 96.44 0.47 Allowed 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.155 1.904 . . . . 0.0 109.838 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.537 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 2.0 m -111.45 122.71 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.064 -1.022 . . . . 0.0 110.549 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.408 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 4.2 p -45.51 129.87 8.63 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.5 -0.75 . . . . 0.0 110.125 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -32.35 -51.37 0.26 Allowed 'General case' 0 N--CA 1.507 2.424 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.245 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.54 -47.85 27.84 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.313 -0.867 . . . . 0.0 111.128 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.438 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 14.8 m -60.05 -45.79 91.67 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.381 -0.824 . . . . 0.0 108.87 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.85 -50.17 70.59 Favored Glycine 0 N--CA 1.493 2.463 0 N-CA-C 110.229 -1.148 . . . . 0.0 110.229 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.7 mt -63.9 -62.11 1.85 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.369 -1.077 . . . . 0.0 110.359 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.554 ' CD1' ' HB2' ' A' ' 42' ' ' ARG . 21.0 t80 -51.67 -44.15 62.96 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.317 -0.864 . . . . 0.0 109.177 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.475 ' O ' ' N ' ' A' ' 39' ' ' GLN . 23.4 t80 -50.81 -48.48 59.72 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.573 -0.705 . . . . 0.0 109.41 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.22 -37.98 88.98 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.043 -1.035 . . . . 0.0 110.657 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 7.5 mp -46.19 -53.97 9.56 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.05 -1.031 . . . . 0.0 110.008 -179.618 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.489 ' HB2' HG23 ' A' ' 40' ' ' VAL . 88.1 m-70 -112.05 10.15 20.38 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.268 -0.895 . . . . 0.0 109.73 179.045 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.475 ' N ' ' O ' ' A' ' 35' ' ' TYR . 2.5 tt0 47.62 35.12 4.1 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.4 -0.813 . . . . 0.0 110.136 -178.679 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.489 HG23 ' HB2' ' A' ' 38' ' ' HIS . 3.7 m -132.94 -177.9 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 O-C-N 121.517 -0.74 . . . . 0.0 109.385 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -75.59 179.47 5.32 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.278 -0.889 . . . . 0.0 110.661 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.554 ' HB2' ' CD1' ' A' ' 34' ' ' TYR . 10.0 ttp180 -150.19 132.62 8.08 Favored Pre-proline 0 N--CA 1.498 1.957 0 O-C-N 121.198 -0.939 . . . . 0.0 109.787 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.407 ' HD2' ' HG2' ' A' ' 42' ' ' ARG . 1.2 Cg_endo -63.79 149.36 90.92 Favored 'Trans proline' 0 C--N 1.316 -1.154 0 C-N-CA 122.155 1.904 . . . . 0.0 110.657 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.552 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 1.1 pp -85.98 -1.47 57.36 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.02 -1.05 . . . . 0.0 110.245 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 t -61.3 -11.39 9.61 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.119 -0.988 . . . . 0.0 110.856 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.19 -7.36 48.54 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.782 -1.198 . . . . 0.0 110.694 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.609 ' HD3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -74.18 172.92 10.89 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.556 -1.34 . . . . 0.0 110.253 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' HG3' ' N ' ' A' ' 49' ' ' ASP . 1.9 tppp? -136.61 163.98 29.29 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.25 -0.906 . . . . 0.0 109.3 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . 0.411 ' N ' ' HG3' ' A' ' 48' ' ' LYS . 6.4 t70 -49.09 -80.46 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.478 -0.764 . . . . 0.0 110.351 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.85 161.96 26.1 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.445 HG22 HD11 ' A' ' 51' ' ' ILE . 5.4 mt -57.06 126.58 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.291 -1.123 . . . . 0.0 109.737 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.444 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -69.15 154.23 42.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.498 -0.751 . . . . 0.0 109.58 179.749 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.428 ' HB ' ' OP1' ' C' ' 125' ' ' ' DT' . 0.0 OUTLIER -156.19 162.41 40.19 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.166 -0.959 . . . . 0.0 109.515 179.016 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 5.6 mmm180 -150.88 -172.61 4.25 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.54 -0.725 . . . . 0.0 110.421 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.19 79.53 0.97 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.13 -0.981 . . . . 0.0 109.562 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.44 ' HD2' " O3'" ' C' ' 125' ' ' ' DT' . 0.0 OUTLIER -58.58 162.2 4.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.604 -0.685 . . . . 0.0 110.41 -179.689 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.8 pttt -57.54 164.5 1.94 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.442 -0.786 . . . . 0.0 109.919 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 6.2 m -68.65 162.57 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.015 -1.053 . . . . 0.0 109.714 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 m -81.31 90.38 6.13 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.169 -0.957 . . . . 0.0 108.711 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.499 2.007 0 O-C-N 121.55 -0.719 . . . . 0.0 110.253 -179.053 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.529 ' C6 ' ' C6 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.688 0 O4'-C1'-N19 110.556 3.444 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.529 ' C6 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.821 1 O4'-C1'-N19 111.243 4.303 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.431 " O5'" H2'' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.292 1 O4'-C1'-N19 111.231 4.289 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.5 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.285 0 O4'-C1'-N19 110.953 3.942 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.5 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.693 0 O4'-C1'-N19 110.499 3.374 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.44 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.441 1.614 0 O4'-C1'-N19 110.659 3.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.44 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.707 0 O4'-C1'-N19 110.89 3.862 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.425 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.879 0 O4'-C1'-N19 110.461 3.327 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.613 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 P--O5' 1.61 1.668 1 O4'-C1'-N19 111.326 4.407 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.613 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.625 1 O4'-C1'-N19 112.032 5.29 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.42 ' C5 ' ' C2 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.766 1 O4'-C1'-N19 112.106 5.382 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.46 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.509 0 O4'-C1'-N19 110.416 3.27 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.46 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.535 2.974 0 O4'-C1'-N19 110.82 3.775 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.612 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.204 1 O4'-C1'-N19 112.331 5.664 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.612 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.535 0 O4'-C1'-N19 110.766 3.708 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.447 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.53 2.408 0 O4'-C1'-N19 110.991 3.988 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.037 0 CA-C-O 120.49 0.186 . . . . 0.0 110.562 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.43 -31.3 14.7 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.052 -1.03 . . . . 0.0 110.036 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -57.66 119.93 7.46 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.257 -0.902 . . . . 0.0 108.954 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.38 -26.67 4.1 Favored Glycine 0 N--CA 1.495 2.624 0 N-CA-C 109.275 -1.53 . . . . 0.0 109.275 -179.101 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.518 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 98.5 m -59.46 91.7 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.277 -1.131 . . . . 0.0 109.349 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 21.0 m -83.91 111.0 19.26 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.049 -1.032 . . . . 0.0 108.261 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.494 ' CB ' HG23 ' A' ' 12' ' ' THR . 40.8 t -48.24 109.5 0.24 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.438 -0.789 . . . . 0.0 110.158 -178.733 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.6 m -58.29 -12.15 3.42 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.43 -0.794 . . . . 0.0 111.368 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.451 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.9 OUTLIER -96.16 -30.67 13.38 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.965 -1.084 . . . . 0.0 110.793 -179.68 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.577 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 17.4 p -141.03 19.3 2.28 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.661 -1.274 . . . . 0.0 111.41 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.435 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.9 OUTLIER 47.5 25.61 0.66 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.321 -0.862 . . . . 0.0 111.768 179.199 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.494 HG23 ' CB ' ' A' ' 7' ' ' CYS . 8.1 t -87.49 132.96 33.84 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.81 -1.181 . . . . 0.0 109.816 179.36 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 94.8 p -90.24 -23.15 21.32 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.3 p -98.99 130.91 45.36 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.542 HG22 ' CZ3' ' A' ' 18' ' ' TRP . 12.9 p -148.82 138.44 21.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.271 -0.893 . . . . 0.0 109.646 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.573 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 2.5 p -64.15 -34.87 79.05 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.582 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 46.7 mt -144.48 104.78 4.1 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 121.401 0.62 . . . . 0.0 109.5 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.542 ' CZ3' HG22 ' A' ' 15' ' ' THR . 6.5 m95 -62.56 99.93 0.17 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.191 -0.943 . . . . 0.0 109.85 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.471 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -83.94 82.08 8.5 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.395 -0.815 . . . . 0.0 108.954 179.568 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.45 ' NH1' ' HG3' ' A' ' 26' ' ' PRO . 4.1 tpp180 -63.06 96.14 0.09 Allowed 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -58.81 133.6 86.64 Favored Pre-proline 0 N--CA 1.495 1.798 0 O-C-N 121.385 -0.822 . . . . 0.0 110.289 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -56.4 -33.08 91.0 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 C-N-CA 122.517 2.145 . . . . 0.0 110.556 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -23.91 31.58 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.386 -0.821 . . . . 0.0 109.767 178.834 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.49 26.95 3.24 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -132.63 112.39 13.86 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 120.959 -1.318 . . . . 0.0 110.408 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.518 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 1.1 Cg_endo -67.95 105.95 1.24 Allowed 'Trans proline' 0 C--N 1.313 -1.321 0 C-N-CA 122.09 1.86 . . . . 0.0 109.474 178.442 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.478 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.1 m -121.56 127.27 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.086 -1.009 . . . . 0.0 110.246 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.483 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.4 p -48.98 132.28 18.71 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.457 -0.777 . . . . 0.0 109.09 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.582 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.8 t-20 -35.7 -48.09 0.52 Allowed 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.685 -0.634 . . . . 0.0 111.761 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -45.42 -51.67 11.1 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.346 -0.847 . . . . 0.0 110.9 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.451 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 32.8 m -61.28 -47.99 83.44 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.395 -0.816 . . . . 0.0 109.243 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.07 -33.56 75.06 Favored Glycine 0 N--CA 1.497 2.75 0 N-CA-C 110.841 -0.903 . . . . 0.0 110.841 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.409 ' HB3' ' C7 ' ' C' ' 123' ' ' ' DT' . 68.0 mt -74.16 -62.45 1.51 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.252 -1.146 . . . . 0.0 110.19 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.499 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 25.0 t80 -55.52 -40.66 72.07 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.102 -0.999 . . . . 0.0 108.917 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.467 ' O ' ' N ' ' A' ' 39' ' ' GLN . 40.9 t80 -54.89 -46.13 74.77 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 0.0 109.675 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -61.36 -32.85 72.76 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.761 -1.212 . . . . 0.0 110.3 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.414 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -57.95 -62.13 2.03 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.214 -0.928 . . . . 0.0 110.863 -179.338 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.502 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 47.0 m-70 -105.0 9.8 34.34 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.011 -1.056 . . . . 0.0 110.364 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.502 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.3 OUTLIER 50.05 27.47 2.51 Favored 'General case' 0 N--CA 1.505 2.303 0 CA-C-O 121.589 0.709 . . . . 0.0 110.685 -179.117 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.408 HG23 ' CB ' ' A' ' 38' ' ' HIS . 6.2 m -130.94 160.95 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 O-C-N 121.237 -0.914 . . . . 0.0 110.19 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -79.87 162.49 24.99 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.371 0.605 . . . . 0.0 110.101 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.499 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -145.98 150.49 42.51 Favored Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.298 -0.876 . . . . 0.0 109.954 179.509 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -59.11 146.77 93.27 Favored 'Trans proline' 0 C--N 1.315 -1.213 0 C-N-CA 122.534 2.156 . . . . 0.0 111.031 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.577 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -83.93 37.21 0.59 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.297 -0.877 . . . . 0.0 110.865 -179.866 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.0 p -68.14 -8.38 38.02 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.007 -1.058 . . . . 0.0 110.293 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.3 mmm -93.0 -20.26 20.76 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.11 -0.994 . . . . 0.0 110.304 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.525 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -66.77 142.68 57.29 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.88 -1.137 . . . . 0.0 109.614 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -131.59 -155.42 0.69 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.35 -0.844 . . . . 0.0 109.53 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.15 -84.85 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.453 -0.779 . . . . 0.0 110.644 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -110.52 170.45 14.02 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.281 -1.527 . . . . 0.0 109.281 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.568 ' CG2' HG22 ' A' ' 16' ' ' THR . 5.3 mt -52.6 130.15 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.259 -1.142 . . . . 0.0 110.256 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.48 165.69 24.78 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.496 0.665 . . . . 0.0 109.545 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.88 166.52 29.29 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.292 -0.88 . . . . 0.0 109.287 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.67 -168.05 3.0 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.509 -0.744 . . . . 0.0 109.749 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.72 113.02 11.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.103 -0.998 . . . . 0.0 108.835 179.365 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.47 ' HD3' ' OP1' ' C' ' 126' ' ' ' DC' . 2.7 ttp180 -51.43 151.69 2.94 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.451 -0.781 . . . . 0.0 109.964 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.437 ' N ' ' HG3' ' A' ' 56' ' ' ARG . 0.1 OUTLIER -79.96 136.45 36.63 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.379 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 6.4 p -51.66 146.04 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.307 -0.871 . . . . 0.0 108.901 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.8 p -48.29 100.51 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.178 -0.951 . . . . 0.0 109.472 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.501 2.088 0 O-C-N 121.755 -0.591 . . . . 0.0 110.74 -178.636 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.58 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.79 0 O4'-C1'-N19 110.44 3.3 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.58 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.778 1 O4'-C1'-N19 111.763 4.954 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.557 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.091 1 O4'-C1'-N19 111.238 4.298 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.562 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.052 1 O4'-C1'-N19 111.051 4.064 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.562 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.612 1.873 0 O4'-C1'-N19 110.655 3.568 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.787 0 O4'-C1'-N19 110.461 3.326 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.429 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.558 1 O4'-C1'-N19 111.118 4.148 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.429 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.442 1.694 0 O4'-C1'-N19 110.351 3.189 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.565 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.808 0 O4'-C1'-N19 110.669 3.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.565 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.401 1 O4'-C1'-N19 111.734 4.918 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.484 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.453 0 O4'-C1'-N19 110.977 3.971 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.559 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.143 0 O4'-C1'-N19 110.814 3.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.559 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.321 0 O4'-C1'-N19 110.656 3.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.599 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.663 1 O4'-C1'-N19 112.207 5.509 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.599 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.93 0 O4'-C1'-N19 110.662 3.577 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.454 ' C6 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.135 1 O4'-C1'-N19 111.064 4.08 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.8 ttpp . . . . . 0 N--CA 1.497 1.889 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -85.76 54.01 2.98 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.867 -1.146 . . . . 0.0 110.052 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.08 157.59 12.72 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.143 -0.973 . . . . 0.0 109.291 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 101.07 -46.66 1.28 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 108.635 -1.786 . . . . 0.0 108.635 -178.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.451 HG21 ' CB ' ' A' ' 26' ' ' PRO . 53.1 m -83.13 93.38 7.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.137 -1.213 . . . . 0.0 108.844 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.6 m -98.21 121.13 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.504 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 46.5 t -50.22 113.56 0.9 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.374 -0.829 . . . . 0.0 110.151 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.6 m -62.95 -11.84 21.44 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.139 -0.976 . . . . 0.0 111.112 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 m-20 -95.53 -31.68 13.21 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.911 -1.118 . . . . 0.0 110.747 -179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.434 ' SG ' ' CG2' ' A' ' 12' ' ' THR . 16.4 p -139.5 18.33 2.55 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.781 -1.199 . . . . 0.0 110.946 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.446 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 48.18 24.93 0.73 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.269 -0.894 . . . . 0.0 112.246 178.815 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.49 ' HB ' ' HD2' ' A' ' 47' ' ' ARG . 14.6 t -87.35 135.18 33.42 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.602 -1.312 . . . . 0.0 110.061 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.4 p -90.13 -16.14 30.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.487 -0.758 . . . . 0.0 109.145 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 44.9 p -102.92 129.56 49.68 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.289 -0.882 . . . . 0.0 108.713 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.487 HG22 ' CZ2' ' A' ' 18' ' ' TRP . 7.0 p -146.36 148.76 32.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.204 -0.935 . . . . 0.0 110.092 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.578 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 32.8 p -72.03 -37.25 69.78 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 10.3 mt -147.07 105.55 3.8 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.237 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.487 ' CZ2' HG22 ' A' ' 15' ' ' THR . 11.4 m95 -59.51 98.62 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.466 -0.771 . . . . 0.0 110.306 -179.146 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.67 75.91 3.34 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.326 -0.859 . . . . 0.0 108.784 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.433 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.08 94.75 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.4 139.97 96.52 Favored Pre-proline 0 N--CA 1.499 1.992 0 O-C-N 121.44 -0.788 . . . . 0.0 110.429 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -53.98 -39.15 86.18 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 C-N-CA 122.832 2.355 . . . . 0.0 111.184 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -22.43 48.44 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.273 -0.892 . . . . 0.0 109.69 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.77 32.81 2.57 Favored Glycine 0 N--CA 1.498 2.77 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -128.04 98.13 27.79 Favored Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.167 -1.196 . . . . 0.0 110.076 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.504 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.1 Cg_endo -65.08 112.88 2.18 Favored 'Trans proline' 0 C--N 1.312 -1.381 0 C-N-CA 122.26 1.973 . . . . 0.0 110.191 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.435 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -124.28 131.2 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.151 -0.968 . . . . 0.0 109.953 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.479 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 6.1 p -53.67 134.73 41.62 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.43 0.633 . . . . 0.0 109.763 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -36.87 -44.73 0.51 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.724 -0.61 . . . . 0.0 112.075 -178.455 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.79 -47.81 59.64 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.331 -0.855 . . . . 0.0 110.187 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 55.9 m -68.36 -39.51 81.79 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.143 -0.973 . . . . 0.0 109.116 179.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.07 -36.91 69.25 Favored Glycine 0 N--CA 1.497 2.751 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 61.8 mt -80.17 -58.29 3.22 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.312 -1.11 . . . . 0.0 110.107 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.552 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 23.6 t80 -51.61 -36.69 46.75 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.539 ' O ' ' N ' ' A' ' 39' ' ' GLN . 17.9 t80 -59.79 -51.7 68.61 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.312 -0.867 . . . . 0.0 109.56 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -52.75 -26.15 13.3 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.664 -1.273 . . . . 0.0 110.353 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.4 mp -72.45 -66.33 0.67 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.961 -1.087 . . . . 0.0 110.381 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.462 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 77.5 m-70 -94.6 -26.57 16.31 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.992 -1.067 . . . . 0.0 110.797 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.539 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 75.56 25.53 1.21 Allowed 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 121.588 0.709 . . . . 0.0 111.374 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -124.63 167.02 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 120.941 -1.099 . . . . 0.0 110.431 179.049 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.6 p-10 -85.66 131.13 34.4 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.333 -0.854 . . . . 0.0 109.417 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.552 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 25.3 mmt180 -109.16 149.13 39.29 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.088 -1.008 . . . . 0.0 110.325 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.07 150.9 84.78 Favored 'Trans proline' 0 C--N 1.314 -1.263 0 C-N-CA 122.372 2.048 . . . . 0.0 110.431 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.596 ' HB2' ' HD3' ' A' ' 47' ' ' ARG . 0.7 OUTLIER -74.33 29.83 0.08 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.187 -0.946 . . . . 0.0 111.231 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.7 p -67.97 -17.97 64.59 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.458 -1.401 . . . . 0.0 109.483 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.52 2.73 52.71 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.392 -0.818 . . . . 0.0 109.929 179.28 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.596 ' HD3' ' HB2' ' A' ' 44' ' ' LEU . 3.0 ttp180 -67.39 173.11 4.24 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.897 -1.127 . . . . 0.0 109.51 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.76 164.85 37.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.165 -0.96 . . . . 0.0 109.773 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -44.43 -70.25 0.11 Allowed 'General case' 0 N--CA 1.504 2.236 0 CA-C-O 121.419 0.628 . . . . 0.0 109.626 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -121.38 175.16 16.12 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 108.632 -1.787 . . . . 0.0 108.632 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.8 mt -51.39 124.73 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.277 -1.131 . . . . 0.0 109.706 179.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.519 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -70.27 160.63 31.84 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.306 -0.871 . . . . 0.0 108.654 179.238 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.95 165.54 36.16 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.085 -1.01 . . . . 0.0 108.996 179.478 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -143.55 -178.33 5.84 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.213 -0.929 . . . . 0.0 109.523 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -52.15 123.67 11.18 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.31 -0.869 . . . . 0.0 108.722 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -48.41 113.48 0.76 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.61 -0.682 . . . . 0.0 109.43 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.427 ' O ' ' C ' ' A' ' 58' ' ' VAL . 24.2 ttpt -46.45 120.82 3.06 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.572 -0.705 . . . . 0.0 109.201 -179.622 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . 0.427 ' C ' ' O ' ' A' ' 57' ' ' LYS . 1.1 p -39.53 122.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.6 t -44.83 103.72 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 53.4 p . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.453 0.644 . . . . 0.0 110.232 -178.371 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.539 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C1'-N19 110.518 3.397 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.569 ' N7 ' HD12 ' A' ' 17' ' ' LEU . . . . . . . . 0 P--O5' 1.609 1.584 1 O4'-C1'-N19 111.621 4.776 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.427 " O5'" H2'' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.562 1 O4'-C1'-N19 111.119 4.149 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.539 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.483 1 O4'-C1'-N19 111.004 4.005 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.539 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.831 0 O4'-C1'-N19 110.875 3.844 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.437 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.707 0 O4'-C1'-N19 110.604 3.505 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.437 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.764 0 O4'-C1'-N19 110.781 3.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.427 ' N4 ' ' C5 ' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.745 0 O4'-C1'-N19 110.429 3.286 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.624 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.58 1 O4'-C1'-N19 111.248 4.31 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.624 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.458 1 O4'-C1'-N19 112.059 5.324 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.494 " O3'" ' HE3' ' A' ' 46' ' ' MET . . . . . . . . 0 C5'--C4' 1.526 1.931 0 O4'-C1'-N19 110.95 3.937 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.503 ' C5 ' HD11 ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.145 0 O4'-C1'-N19 110.633 3.542 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.5 " H3'" ' CG2' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.532 2.61 0 O4'-C1'-N19 110.737 3.672 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.638 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.557 1 O4'-C1'-N19 112.942 6.427 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.478 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.534 2.876 1 O4'-C1'-N19 111.284 4.355 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.402 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.533 2.691 1 O4'-C1'-N19 111.185 4.231 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.9 mtpt . . . . . 0 N--CA 1.497 1.897 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.45 -43.63 17.03 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.484 -0.76 . . . . 0.0 109.06 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.99 111.04 0.92 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.714 -0.616 . . . . 0.0 109.429 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 115.23 -24.35 10.67 Favored Glycine 0 N--CA 1.496 2.687 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 -179.48 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.467 HG22 ' HB2' ' A' ' 26' ' ' PRO . 30.7 m -71.96 92.38 1.27 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.873 -1.369 . . . . 0.0 109.309 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.6 m -93.54 117.03 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.5 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 44.7 t -45.51 112.37 0.45 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.446 -0.784 . . . . 0.0 110.409 -178.99 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 39.4 m -62.5 -8.94 7.09 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.429 -0.795 . . . . 0.0 111.305 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.41 ' HB2' HG11 ' A' ' 27' ' ' VAL . 1.8 m-80 -104.96 -26.69 12.07 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.797 -1.189 . . . . 0.0 111.199 -179.571 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.574 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 13.1 p -139.67 17.14 2.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.693 -1.254 . . . . 0.0 111.334 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 49.55 22.13 0.71 Allowed 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.237 -0.914 . . . . 0.0 111.995 178.723 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.545 ' HB ' ' SG ' ' A' ' 10' ' ' CYS . 2.0 t -90.04 125.48 35.42 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.799 -1.188 . . . . 0.0 109.473 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.4 p -88.95 -21.66 23.46 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.377 -0.827 . . . . 0.0 109.38 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.4 p -89.52 117.21 28.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.359 -0.838 . . . . 0.0 109.001 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.545 HG21 ' CH2' ' A' ' 18' ' ' TRP . 6.3 p -144.86 147.51 32.9 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.923 -1.111 . . . . 0.0 110.475 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.638 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 77.0 p -80.05 -30.37 39.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.541 -0.724 . . . . 0.0 109.08 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.617 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -144.45 112.02 6.12 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.184 -0.947 . . . . 0.0 109.312 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.545 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.5 m95 -74.67 90.9 2.32 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.107 -0.995 . . . . 0.0 109.749 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.15 83.08 3.64 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.384 -0.822 . . . . 0.0 109.377 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.446 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.6 mmt180 -66.41 110.05 2.96 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.151 -0.968 . . . . 0.0 109.348 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 83.1 p -71.03 149.24 94.74 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.212 -0.93 . . . . 0.0 109.465 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -56.11 -22.34 39.24 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 122.432 2.088 . . . . 0.0 111.229 -179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -75.23 -3.43 33.12 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.196 -0.94 . . . . 0.0 110.169 179.203 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.9 34.41 9.0 Favored Glycine 0 N--CA 1.495 2.597 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -127.47 101.4 24.53 Favored Pre-proline 0 N--CA 1.494 1.741 0 O-C-N 121.458 -1.025 . . . . 0.0 110.43 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.492 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.3 Cg_endo -65.37 105.02 0.68 Allowed 'Trans proline' 0 C--N 1.315 -1.22 0 C-N-CA 122.593 2.195 . . . . 0.0 110.099 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.5 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.74 124.98 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.131 -0.981 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.489 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.0 p -49.19 131.2 19.7 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.459 0.647 . . . . 0.0 110.074 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.617 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 23.5 t-20 -37.18 -48.84 0.87 Allowed 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.629 -0.669 . . . . 0.0 111.548 -178.96 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -45.04 -44.08 9.86 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.425 -0.797 . . . . 0.0 110.296 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.505 ' HB3' ' HD3' ' A' ' 42' ' ' ARG . 3.4 m -64.03 -44.79 91.46 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.29 -33.24 85.46 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.503 HD11 ' C5 ' ' C' ' 123' ' ' ' DT' . 41.6 mt -76.33 -60.45 2.33 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.471 -1.017 . . . . 0.0 109.617 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.54 ' CE1' ' HD2' ' A' ' 43' ' ' PRO . 51.3 t80 -48.05 -38.88 18.39 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.303 -0.873 . . . . 0.0 109.289 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.495 ' CD2' ' O ' ' A' ' 40' ' ' VAL . 58.3 t80 -54.24 -53.9 47.37 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.439 -0.788 . . . . 0.0 109.602 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.04 -38.11 89.89 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.113 -0.992 . . . . 0.0 110.459 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.49 HD12 ' O ' ' A' ' 33' ' ' LEU . 4.1 mp -42.77 -57.5 2.74 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.437 -0.79 . . . . 0.0 110.353 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.572 ' HB2' HG22 ' A' ' 40' ' ' VAL . 33.0 m-70 -118.3 13.69 13.7 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.286 -0.884 . . . . 0.0 109.705 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.47 ' N ' ' O ' ' A' ' 35' ' ' TYR . 17.6 tt0 45.76 47.33 11.9 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 121.842 0.83 . . . . 0.0 109.788 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.572 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.1 m -130.86 -170.82 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 121.545 -0.722 . . . . 0.0 109.71 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -61.69 -173.62 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.267 -0.896 . . . . 0.0 110.177 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.505 ' HD3' ' HB3' ' A' ' 31' ' ' CYS . 29.7 mtt180 -130.0 93.55 33.5 Favored Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 121.1 -1.0 . . . . 0.0 109.976 -179.207 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.54 ' HD2' ' CE1' ' A' ' 34' ' ' TYR . 5.0 Cg_exo -58.75 126.63 21.78 Favored 'Trans proline' 0 C--N 1.318 -1.061 0 C-N-CA 122.559 2.173 . . . . 0.0 110.866 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.574 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -96.88 17.32 17.03 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.45 -0.781 . . . . 0.0 110.586 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.2 p -74.16 -4.57 36.6 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.996 -1.065 . . . . 0.0 110.198 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.494 ' HE3' " O3'" ' C' ' 122' ' ' ' DT' . 1.0 OUTLIER -103.91 -0.66 28.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.082 -1.011 . . . . 0.0 110.626 179.819 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.478 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 9.4 mmm180 -51.13 141.36 14.44 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.628 -1.295 . . . . 0.0 110.215 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmm -119.38 -163.99 1.02 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.514 -0.741 . . . . 0.0 109.52 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -79.51 -89.35 0.06 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.209 -0.932 . . . . 0.0 110.175 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -96.11 165.91 24.34 Favored Glycine 0 N--CA 1.499 2.864 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.4 mt -54.3 129.06 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.246 -1.15 . . . . 0.0 109.767 179.816 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -70.33 141.91 52.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.297 -0.877 . . . . 0.0 109.275 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.72 158.13 40.54 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.946 -1.097 . . . . 0.0 110.159 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.459 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 1.1 mtm-85 -153.16 -158.47 0.89 Allowed 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -58.37 106.11 0.35 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.04 139.29 4.54 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.521 0.677 . . . . 0.0 110.94 -178.475 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.65 140.78 40.19 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.581 -0.699 . . . . 0.0 109.949 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -61.68 163.99 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.529 -0.732 . . . . 0.0 110.228 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.53 110.45 4.2 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.084 -1.01 . . . . 0.0 109.601 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.9 t . . . . . 0 N--CA 1.497 1.875 0 O-C-N 121.123 -0.986 . . . . 0.0 109.498 179.734 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.496 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.441 1.618 0 C5'-C4'-C3' 109.816 -3.256 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.51 H2'' " O5'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.598 1 O4'-C1'-N19 111.371 4.464 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.62 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.804 0 O4'-C1'-N19 110.805 3.756 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.62 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.782 0 O4'-C1'-N19 110.885 3.856 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.453 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.705 0 O4'-C1'-N19 110.719 3.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.798 0 O4'-C1'-N19 110.616 3.52 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.488 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.614 0 O4'-C1'-N19 110.99 3.987 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.488 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.78 0 C3'-C2'-C1' 107.055 3.111 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.654 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.777 1 O4'-C1'-N19 111.005 4.006 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.654 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.649 1 O4'-C1'-N19 111.929 5.162 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.278 0 O4'-C1'-N19 110.919 3.898 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.466 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.674 0 C3'-C2'-C1' 107.106 3.147 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.553 ' H62' ' CD1' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.187 0 O4'-C1'-N19 110.314 3.142 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.599 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.626 1 O4'-C1'-N19 112.209 5.511 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.599 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.595 0 O4'-C1'-N19 110.479 3.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.405 ' O4 ' ' C4 ' ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.118 0 O4'-C1'-N19 110.897 3.871 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.3 ptpp? . . . . . 0 N--CA 1.498 1.974 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -100.66 86.36 3.1 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.498 -0.751 . . . . 0.0 109.392 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.34 141.02 57.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.314 -0.866 . . . . 0.0 109.42 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 94.35 -37.13 3.49 Favored Glycine 0 N--CA 1.497 2.759 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.315 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.4 m -60.61 96.37 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.273 -1.134 . . . . 0.0 109.231 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.8 m -96.94 138.72 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.536 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 22.1 t -59.88 122.67 14.82 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.425 -0.797 . . . . 0.0 110.835 -178.989 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -65.45 -16.04 63.24 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.193 -0.942 . . . . 0.0 109.965 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 34.0 m-20 -104.11 -19.17 14.26 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.031 -1.043 . . . . 0.0 111.209 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.513 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 9.0 p -154.0 26.28 0.48 Allowed 'General case' 0 N--CA 1.502 2.154 0 O-C-N 120.63 -1.294 . . . . 0.0 111.151 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 1.0 OUTLIER 31.15 37.11 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.642 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 178.901 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.59 HG21 HG21 ' A' ' 15' ' ' THR . 5.5 t -90.39 131.85 35.93 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.565 -1.335 . . . . 0.0 108.794 178.586 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 91.6 p -89.39 -26.37 21.06 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.447 -0.783 . . . . 0.0 109.426 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.5 p -99.51 113.3 25.6 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.485 -0.76 . . . . 0.0 109.124 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.59 HG21 HG21 ' A' ' 12' ' ' THR . 6.8 p -132.96 164.29 27.29 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.31 -0.869 . . . . 0.0 110.197 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.57 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 11.5 p -74.85 -45.95 39.67 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.427 ' CD1' ' O6 ' ' B' ' 107' ' ' ' DG' . 12.8 mt -147.57 116.49 6.8 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.691 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -64.96 98.92 0.31 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.475 -0.765 . . . . 0.0 110.112 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.88 75.38 6.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.514 -0.741 . . . . 0.0 109.62 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.425 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.9 tpp180 -64.2 95.59 0.13 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.277 -0.889 . . . . 0.0 108.976 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.14 147.13 47.38 Favored Pre-proline 0 N--CA 1.499 2.017 0 O-C-N 121.437 -0.789 . . . . 0.0 110.133 -179.184 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -56.16 -33.66 91.01 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.383 2.055 . . . . 0.0 110.696 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.8 mtm -60.32 -23.15 63.98 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.214 -0.929 . . . . 0.0 109.537 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.89 45.64 1.01 Allowed Glycine 0 N--CA 1.497 2.733 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -134.84 104.26 10.77 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.468 -1.019 . . . . 0.0 110.277 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.49 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 Cg_endo -66.13 87.59 0.25 Allowed 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 122.317 2.011 . . . . 0.0 109.639 178.918 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.534 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -109.53 124.48 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.111 -0.993 . . . . 0.0 110.371 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.538 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.5 p -46.25 134.28 8.82 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.744 -0.597 . . . . 0.0 109.591 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.424 ' OD1' HD12 ' A' ' 33' ' ' LEU . 2.2 t-20 -34.74 -46.29 0.29 Allowed 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.747 -0.595 . . . . 0.0 111.46 -179.006 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.415 ' HB3' ' OP2' ' C' ' 124' ' ' ' DA' . . . -47.66 -51.81 20.33 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.509 -0.745 . . . . 0.0 111.27 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.512 ' HA ' ' HD3' ' A' ' 42' ' ' ARG . 52.0 m -62.35 -40.86 97.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.148 -0.97 . . . . 0.0 109.885 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.11 -35.69 91.86 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.553 ' CD1' ' H62' ' C' ' 124' ' ' ' DA' . 83.6 mt -73.69 -62.19 1.58 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.294 -1.121 . . . . 0.0 109.717 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.454 ' CE1' ' HB3' ' A' ' 42' ' ' ARG . 32.1 t80 -51.71 -38.36 54.86 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.547 ' O ' ' N ' ' A' ' 39' ' ' GLN . 32.1 t80 -64.28 -43.72 93.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.465 -0.772 . . . . 0.0 110.118 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.521 ' HD2' ' CD1' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -60.44 -21.92 62.84 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 119.988 -1.695 . . . . 0.0 110.059 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.522 ' CD1' ' N ' ' A' ' 37' ' ' LEU . 0.5 OUTLIER -84.74 -59.18 2.43 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.074 -1.016 . . . . 0.0 110.087 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -93.03 -28.48 16.36 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.21 -0.931 . . . . 0.0 109.695 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 35' ' ' TYR . 4.7 tt0 61.86 47.8 5.8 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 122.262 1.029 . . . . 0.0 109.999 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -141.17 168.56 15.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -71.4 125.75 27.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.788 -1.195 . . . . 0.0 108.429 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.512 ' HD3' ' HA ' ' A' ' 31' ' ' CYS . 1.8 ptm180 -95.5 146.99 32.3 Favored Pre-proline 0 N--CA 1.493 1.706 0 O-C-N 121.229 -0.919 . . . . 0.0 109.496 -178.873 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -62.71 133.53 42.66 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 C-N-CA 122.196 1.93 . . . . 0.0 110.565 -179.733 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.5 OUTLIER -76.51 -6.93 53.95 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.468 -0.77 . . . . 0.0 110.375 179.654 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 14.6 t -60.66 -28.09 68.31 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.12 -0.987 . . . . 0.0 110.798 179.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -77.54 -21.44 52.6 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.916 -1.115 . . . . 0.0 110.178 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.546 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -76.08 149.72 37.41 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.022 -1.049 . . . . 0.0 108.997 179.417 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.41 ' N ' ' HG2' ' A' ' 47' ' ' ARG . 34.8 mttm -124.84 -166.07 1.48 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.016 -1.052 . . . . 0.0 110.013 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -91.69 -45.56 8.38 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.072 -1.017 . . . . 0.0 109.9 -179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -95.08 135.46 12.42 Favored Glycine 0 N--CA 1.499 2.873 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.416 HG22 HD12 ' A' ' 51' ' ' ILE . 4.8 mt -50.62 120.97 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.164 -1.197 . . . . 0.0 109.802 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -63.39 151.14 41.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.632 -0.667 . . . . 0.0 109.895 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.436 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -156.32 154.98 31.46 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.977 -1.077 . . . . 0.0 109.366 178.853 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.436 ' HG2' ' O ' ' A' ' 53' ' ' THR . 5.9 mtp180 -150.89 -161.87 1.43 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -53.25 130.73 35.67 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.928 -1.107 . . . . 0.0 109.136 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.431 ' HD3' ' OP1' ' C' ' 126' ' ' ' DC' . 20.3 mtt180 -76.14 160.43 29.75 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.418 -0.801 . . . . 0.0 110.125 -179.053 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -79.5 124.23 28.29 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.358 -0.839 . . . . 0.0 109.722 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.1 t -61.91 144.48 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.48 -0.762 . . . . 0.0 109.467 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.2 t -64.68 100.16 0.37 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.33 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.496 1.862 0 O-C-N 121.335 -0.853 . . . . 0.0 109.684 -179.388 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.516 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.444 1.813 0 O4'-C1'-N19 110.722 3.653 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.516 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.775 1 O4'-C1'-N19 111.645 4.807 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.228 1 O4'-C1'-N19 111.234 4.292 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.452 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.13 1 O4'-C1'-N19 111.12 4.15 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.452 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.141 0 O4'-C1'-N19 110.664 3.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.419 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.018 1 O4'-C1'-N19 111.042 4.052 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.419 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.001 1 O4'-C1'-N19 111.38 4.475 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.411 " H5'" ' CZ ' ' A' ' 54' ' ' ARG . . . . . . . . 0 P--O5' 1.612 1.865 0 C3'-C2'-C1' 107.182 3.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.693 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.786 1 O4'-C1'-N19 111.231 4.288 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.693 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.381 1 O4'-C1'-N19 111.861 5.076 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.47 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.095 1 O4'-C1'-N19 111.169 4.211 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.47 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.756 0 O4'-C1'-N19 110.371 3.214 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.493 " H3'" ' CG2' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.313 0 O4'-C1'-N19 110.705 3.632 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.697 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.527 1.942 1 O4'-C1'-N19 112.169 5.462 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.634 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.791 1 O4'-C1'-N19 111.129 4.161 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.956 1 O4'-C1'-N19 111.109 4.137 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.771 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.3 mpp_? -87.21 7.38 28.64 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.208 -0.933 . . . . 0.0 110.353 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.33 142.97 58.19 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.068 -1.02 . . . . 0.0 109.284 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.51 -30.66 9.2 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 109.211 -1.555 . . . . 0.0 109.211 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.442 HG21 ' HB2' ' A' ' 26' ' ' PRO . 15.5 m -70.77 89.09 0.74 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -1.17 . . . . 0.0 109.627 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 20.3 m -97.06 124.11 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 179.148 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 7.9 t -43.66 113.99 0.58 Allowed 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.395 -0.816 . . . . 0.0 111.269 -178.523 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.3 m -59.62 -10.65 3.75 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.106 -0.996 . . . . 0.0 111.178 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -110.4 -28.66 8.46 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.812 -1.18 . . . . 0.0 110.956 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.54 ' O ' ' HD3' ' A' ' 47' ' ' ARG . 2.4 p -138.32 21.97 2.77 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 120.877 -1.139 . . . . 0.0 110.159 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.505 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER 30.53 37.57 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 179.272 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.459 HG22 ' HB2' ' A' ' 7' ' ' CYS . 14.9 t -90.83 126.22 35.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.783 -1.198 . . . . 0.0 109.072 178.777 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 p -89.66 -15.01 33.6 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.51 -0.744 . . . . 0.0 109.699 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -102.7 99.77 9.76 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.287 -0.883 . . . . 0.0 109.386 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.471 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 6.5 p -122.6 163.05 20.71 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.175 -0.953 . . . . 0.0 110.292 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.697 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 81.9 p -94.11 -32.17 13.87 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.638 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 67.5 mt -142.75 87.23 1.98 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.317 -0.864 . . . . 0.0 109.263 179.119 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.471 ' CZ2' HG23 ' A' ' 15' ' ' THR . 13.1 m95 -54.54 109.27 0.48 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.077 -1.014 . . . . 0.0 110.162 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.513 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -101.66 130.23 47.98 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.348 -0.845 . . . . 0.0 109.018 179.658 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.9 mmt180 -97.27 109.62 22.34 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.248 -0.908 . . . . 0.0 108.875 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.74 146.5 98.49 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.177 -0.952 . . . . 0.0 109.392 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -58.1 -21.09 49.17 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 C-N-CA 122.2 1.934 . . . . 0.0 110.613 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 10.8 mtt -81.54 -0.96 44.43 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.317 -0.864 . . . . 0.0 109.788 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.89 35.43 7.73 Favored Glycine 0 N--CA 1.497 2.711 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -124.22 105.24 31.47 Favored Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.386 -1.067 . . . . 0.0 110.524 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.442 ' HB2' HG21 ' A' ' 5' ' ' THR . 1.5 Cg_endo -66.63 93.27 0.31 Allowed 'Trans proline' 0 C--N 1.314 -1.27 0 C-N-CA 122.235 1.957 . . . . 0.0 109.579 178.611 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.534 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -109.75 124.47 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 121.107 -0.996 . . . . 0.0 110.561 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.402 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.4 p -45.97 131.43 9.72 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.753 -0.592 . . . . 0.0 110.398 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.638 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 7.2 t-20 -36.63 -45.56 0.53 Allowed 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.708 -0.62 . . . . 0.0 111.934 -178.869 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.24 -49.05 34.77 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.563 -0.711 . . . . 0.0 109.93 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.604 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 8.9 m -59.65 -46.35 89.27 Favored 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -55.03 -54.6 32.83 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.515 ' O ' HD12 ' A' ' 37' ' ' LEU . 96.0 mt -59.23 -57.62 12.24 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.644 -0.915 . . . . 0.0 109.594 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.412 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 30.6 t80 -43.8 -36.4 2.29 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.339 -0.851 . . . . 0.0 109.59 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.49 ' O ' ' N ' ' A' ' 39' ' ' GLN . 38.7 t80 -58.82 -52.81 64.12 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.333 -0.854 . . . . 0.0 109.722 178.904 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -65.65 -26.97 68.05 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.964 -1.085 . . . . 0.0 110.483 -179.945 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.515 HD12 ' O ' ' A' ' 33' ' ' LEU . 9.8 mp -53.53 -57.69 9.82 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.215 -0.928 . . . . 0.0 109.285 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.489 ' CB ' HG21 ' A' ' 40' ' ' VAL . 76.8 m-70 -113.79 11.65 18.07 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.18 -0.95 . . . . 0.0 109.771 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.49 ' N ' ' O ' ' A' ' 35' ' ' TYR . 4.9 tm0? 51.92 30.93 7.77 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.362 -0.836 . . . . 0.0 110.018 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.489 HG21 ' CB ' ' A' ' 38' ' ' HIS . 3.2 m -131.38 -171.29 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.35 -0.844 . . . . 0.0 109.516 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -66.72 -173.2 0.21 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.249 -0.907 . . . . 0.0 110.105 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.604 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -142.78 116.62 6.3 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.102 -0.999 . . . . 0.0 109.702 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -63.37 147.79 93.25 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 C-N-CA 122.069 1.846 . . . . 0.0 110.302 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.37 16.71 9.61 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.199 -0.938 . . . . 0.0 110.392 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.06 -12.95 60.21 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.054 -1.029 . . . . 0.0 109.858 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.417 ' O ' ' HG3' ' A' ' 46' ' ' MET . 0.0 OUTLIER -89.36 -5.23 57.65 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.034 -1.041 . . . . 0.0 110.664 179.632 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.54 ' HD3' ' O ' ' A' ' 10' ' ' CYS . 65.6 mtm180 -57.27 165.25 1.48 Allowed 'General case' 0 N--CA 1.504 2.236 0 O-C-N 120.65 -1.281 . . . . 0.0 110.571 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.22 145.62 31.39 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.421 -0.799 . . . . 0.0 109.926 179.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -47.6 -36.57 10.96 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.636 -0.665 . . . . 0.0 110.01 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.0 146.84 18.76 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 108.48 -1.848 . . . . 0.0 108.48 179.042 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.447 HG22 HG21 ' A' ' 16' ' ' THR . 5.3 mt -46.73 114.79 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 121.474 -1.015 . . . . 0.0 110.016 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -51.55 142.32 14.37 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.579 -0.701 . . . . 0.0 109.497 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.36 159.09 39.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.96 -1.087 . . . . 0.0 110.054 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.411 ' CZ ' " H5'" ' B' ' 113' ' ' ' DC' . 0.1 OUTLIER -150.57 -157.65 0.83 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.703 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -62.74 97.18 0.1 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 120.884 -1.135 . . . . 0.0 108.726 179.048 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.438 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 0.2 OUTLIER -45.06 143.59 1.51 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.678 -0.639 . . . . 0.0 110.473 -179.114 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.448 ' HE2' " O4'" ' B' ' 110' ' ' ' DA' . 0.0 OUTLIER -54.92 119.53 5.54 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.397 -0.814 . . . . 0.0 110.086 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.4 p -67.91 139.4 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.536 -0.728 . . . . 0.0 109.545 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.6 m -66.76 109.49 2.9 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.314 -0.866 . . . . 0.0 110.49 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.2 t . . . . . 0 N--CA 1.495 1.798 0 O-C-N 121.388 -0.82 . . . . 0.0 109.594 179.554 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.573 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.919 0 O4'-C1'-N19 110.61 3.512 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.573 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.081 1 O4'-C1'-N19 111.685 4.856 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.493 ' C4 ' ' C2 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.511 1 O4'-C1'-N19 111.307 4.383 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.488 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.552 1 O4'-C1'-N19 111.288 4.36 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.488 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.612 1.896 0 O4'-C1'-N19 110.6 3.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.442 1.718 0 O4'-C1'-N19 110.791 3.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.643 1 O4'-C1'-N19 111.537 4.671 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.861 0 O4'-C1'-N19 110.531 3.414 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.662 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.832 0 O4'-C1'-N19 110.977 3.971 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.662 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.594 1 O4'-C1'-N19 111.83 5.037 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.475 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.089 0 O4'-C1'-N19 110.999 3.999 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.475 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.722 0 O4'-C1'-N19 110.531 3.414 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.488 ' N6 ' ' N6 ' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.568 0 O4'-C1'-N19 110.656 3.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.621 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.321 1 O4'-C1'-N19 112.465 5.831 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.533 " H2'" ' C5 ' ' C' ' 127' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.726 0 O4'-C1'-N19 110.757 3.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.533 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 P--O5' 1.616 2.33 1 O4'-C1'-N19 111.029 4.036 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.5 tptt . . . . . 0 N--CA 1.498 1.961 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.27 -41.68 76.22 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.121 -0.987 . . . . 0.0 109.352 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.99 152.61 19.38 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.771 -0.581 . . . . 0.0 109.589 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.32 -19.67 50.99 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.554 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 54.5 m -69.19 87.84 0.42 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.049 -1.266 . . . . 0.0 109.249 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 34.6 m -78.8 110.12 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 179.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.511 ' CB ' HG23 ' A' ' 12' ' ' THR . 41.0 t -47.44 109.44 0.22 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.262 -0.899 . . . . 0.0 110.391 -178.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 24.7 m -59.39 -12.49 6.03 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.326 -0.859 . . . . 0.0 111.628 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.1 m120 -95.61 -28.84 14.64 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.612 -1.305 . . . . 0.0 111.059 -179.813 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.624 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 15.0 p -142.37 17.22 2.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.863 -1.148 . . . . 0.0 111.494 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 4.3 mp0 53.43 18.65 1.4 Allowed 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.2 -0.937 . . . . 0.0 112.052 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.511 HG23 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -84.15 128.72 34.74 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.401 -1.437 . . . . 0.0 109.786 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.2 p -89.72 -28.46 19.39 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.444 -0.785 . . . . 0.0 109.533 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.414 ' HB ' HG13 ' A' ' 51' ' ' ILE . 27.9 p -93.32 127.44 38.92 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.547 HG21 ' CH2' ' A' ' 18' ' ' TRP . 4.8 p -146.44 145.49 30.25 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.034 -1.041 . . . . 0.0 110.097 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.621 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 25.1 p -68.0 -32.06 72.18 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.104 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.519 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 13.5 mt -149.03 122.6 9.15 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.332 -0.855 . . . . 0.0 109.57 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.547 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.8 m95 -80.89 109.13 15.17 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.302 -0.874 . . . . 0.0 110.255 -179.535 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.09 78.69 4.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.39 -0.819 . . . . 0.0 108.904 179.452 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.8 122.9 15.99 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.216 -0.927 . . . . 0.0 109.872 -179.554 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.7 143.26 37.95 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.592 -0.693 . . . . 0.0 109.518 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -56.86 -38.82 94.98 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.496 2.13 . . . . 0.0 110.742 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.36 -23.73 50.83 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.405 -0.809 . . . . 0.0 109.586 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.78 39.06 1.63 Allowed Glycine 0 N--CA 1.496 2.658 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -133.18 97.15 16.73 Favored Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.397 -1.061 . . . . 0.0 110.177 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.554 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 2.9 Cg_endo -63.98 112.68 1.91 Allowed 'Trans proline' 0 C--N 1.312 -1.387 0 C-N-CA 122.091 1.861 . . . . 0.0 109.952 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.498 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 3.3 m -122.62 129.1 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.074 -1.017 . . . . 0.0 110.5 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.51 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.2 p -52.68 139.2 26.84 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 121.441 0.638 . . . . 0.0 110.559 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.519 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 19.7 t-20 -40.35 -47.78 2.58 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.88 -0.512 . . . . 0.0 112.071 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.43 -41.68 52.91 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.195 -0.941 . . . . 0.0 110.355 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.42 ' HB3' ' HD2' ' A' ' 42' ' ' ARG . 9.6 m -66.77 -36.81 83.29 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.156 -0.965 . . . . 0.0 108.526 178.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.81 -48.79 59.24 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 93.8 mt -61.04 -59.44 5.36 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.583 -0.951 . . . . 0.0 109.619 179.953 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.471 ' CD1' ' HB3' ' A' ' 42' ' ' ARG . 18.4 t80 -47.97 -40.35 22.07 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.564 -0.71 . . . . 0.0 109.515 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.432 ' HB2' ' NH1' ' A' ' 42' ' ' ARG . 41.4 t80 -58.33 -49.9 75.53 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.313 -0.867 . . . . 0.0 109.62 179.209 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 tttt -61.14 -34.66 75.36 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.979 -1.076 . . . . 0.0 109.945 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.424 ' N ' HD13 ' A' ' 37' ' ' LEU . 9.1 mp -53.62 -63.27 1.2 Allowed 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.657 -0.652 . . . . 0.0 110.682 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.535 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 83.1 m-70 -105.93 12.58 30.44 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.121 -0.987 . . . . 0.0 110.39 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.535 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER 47.42 28.35 1.1 Allowed 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 121.614 0.721 . . . . 0.0 110.895 -179.327 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.434 HG21 ' CB ' ' A' ' 38' ' ' HIS . 8.2 m -130.96 -170.45 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 O-C-N 121.203 -0.936 . . . . 0.0 109.873 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -62.47 -177.27 0.13 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.497 -0.752 . . . . 0.0 109.853 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.471 ' HB3' ' CD1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -146.28 111.17 4.33 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 120.902 -1.124 . . . . 0.0 110.179 -179.524 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -60.15 134.04 53.56 Favored 'Trans proline' 0 C--N 1.316 -1.157 0 C-N-CA 122.115 1.877 . . . . 0.0 110.298 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.624 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 1.2 pp -88.8 9.93 22.83 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.303 -0.873 . . . . 0.0 110.835 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 43.7 p -70.36 -9.93 57.6 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.064 -1.022 . . . . 0.0 110.569 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 ttt -95.77 -22.05 17.75 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.94 -1.1 . . . . 0.0 110.531 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.441 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -67.27 152.02 46.47 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.829 -1.169 . . . . 0.0 110.055 -179.895 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.402 ' HB2' ' OE1' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -106.94 -160.52 0.74 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.379 -0.826 . . . . 0.0 109.716 179.836 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -47.67 -73.2 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.264 -0.897 . . . . 0.0 110.698 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -136.48 -158.52 8.09 Favored Glycine 0 N--CA 1.498 2.778 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.414 HG13 ' HB ' ' A' ' 14' ' ' THR . 9.3 mt -50.91 111.15 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.223 -1.163 . . . . 0.0 110.033 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.402 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -78.16 156.45 29.87 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.423 -0.798 . . . . 0.0 109.213 179.612 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -154.99 163.05 40.85 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.137 -0.977 . . . . 0.0 109.718 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.85 -168.77 3.2 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.04 124.88 23.75 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.944 -1.097 . . . . 0.0 108.99 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.5 mtt180 -53.22 136.84 35.72 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.438 -0.789 . . . . 0.0 110.07 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.43 151.02 41.28 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.538 -0.727 . . . . 0.0 109.799 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.3 p -52.69 138.91 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.336 -0.853 . . . . 0.0 109.88 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.65 111.06 1.68 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.3 -0.875 . . . . 0.0 109.475 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.6 t . . . . . 0 N--CA 1.498 1.947 0 O-C-N 121.649 -0.657 . . . . 0.0 110.205 -179.491 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.504 ' C6 ' ' C6 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.524 1.663 0 O4'-C1'-N19 110.526 3.407 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.574 ' N7 ' HD13 ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.442 1.664 0 O4'-C1'-N19 110.784 3.73 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.583 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.914 0 O4'-C1'-N19 110.904 3.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.583 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.694 0 O4'-C1'-N19 110.659 3.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.421 H2'' ' C8 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.821 0 O4'-C1'-N19 110.859 3.824 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.421 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.805 0 O4'-C1'-N19 110.675 3.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.489 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.442 1.694 1 O4'-C1'-N19 111.297 4.372 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.489 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.819 0 C3'-C2'-C1' 107.194 3.21 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.657 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.796 0 O4'-C1'-N19 110.712 3.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.657 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.669 1 O4'-C1'-N19 111.672 4.84 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.487 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.213 1 O4'-C1'-N19 111.026 4.033 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.487 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 P--O5' 1.61 1.707 0 C3'-C2'-C1' 107.088 3.134 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.649 ' H62' ' CD1' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.531 2.486 0 O4'-C1'-N19 110.541 3.427 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.651 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.808 1 O4'-C1'-N19 112.641 6.051 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.461 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.534 2.838 0 O4'-C1'-N19 110.84 3.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.446 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.2 0 O4'-C1'-N19 110.874 3.843 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.498 1.959 0 CA-C-O 120.437 0.16 . . . . 0.0 111.333 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.3 -27.03 60.53 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.73 -1.231 . . . . 0.0 109.839 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.9 140.73 41.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.28 -0.887 . . . . 0.0 109.407 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.31 -22.57 32.5 Favored Glycine 0 N--CA 1.498 2.806 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 -179.315 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.457 HG23 ' CZ3' ' A' ' 18' ' ' TRP . 26.4 m -66.9 99.87 0.67 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.121 -1.223 . . . . 0.0 109.717 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.435 ' O ' HG22 ' A' ' 6' ' ' VAL . 6.8 m -97.82 104.32 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.311 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.584 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 42.3 t -40.72 106.88 0.06 Allowed 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.719 -0.613 . . . . 0.0 110.549 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.4 m -57.31 -17.22 11.16 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.554 -0.716 . . . . 0.0 111.595 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.513 ' HB2' HG13 ' A' ' 27' ' ' VAL . 5.3 m120 -95.43 -30.91 13.63 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.654 -1.278 . . . . 0.0 111.419 -179.018 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.487 ' O ' ' CD ' ' A' ' 47' ' ' ARG . 13.3 p -133.15 17.94 4.08 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.557 -1.34 . . . . 0.0 111.06 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 7' ' ' CYS . 26.4 mt-30 44.67 31.78 0.69 Allowed 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.318 -0.863 . . . . 0.0 112.108 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.515 HG23 HG23 ' A' ' 15' ' ' THR . 3.2 t -90.61 127.38 36.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.655 -1.278 . . . . 0.0 109.376 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.21 -20.48 24.13 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.578 -0.701 . . . . 0.0 109.29 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 18.7 p -106.79 133.86 50.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.209 -0.932 . . . . 0.0 109.021 179.184 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.515 HG23 HG23 ' A' ' 12' ' ' THR . 8.0 p -146.06 156.59 43.57 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.219 -0.926 . . . . 0.0 110.502 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.651 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 43.4 p -87.02 -29.59 21.85 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.647 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 24.5 mt -146.33 91.01 2.0 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.282 -0.886 . . . . 0.0 109.289 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.51 ' CZ2' HG22 ' A' ' 15' ' ' THR . 9.8 m95 -54.7 102.67 0.07 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.947 -1.095 . . . . 0.0 109.545 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -101.13 95.22 6.41 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.454 -0.779 . . . . 0.0 110.128 -178.935 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.424 ' HD3' ' HA ' ' A' ' 26' ' ' PRO . 9.3 mmt180 -62.74 110.29 1.69 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.194 -0.942 . . . . 0.0 108.895 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.5 ' HB2' HG23 ' A' ' 27' ' ' VAL . 0.4 OUTLIER -71.6 137.78 83.25 Favored Pre-proline 0 N--CA 1.496 1.862 0 O-C-N 121.195 -0.941 . . . . 0.0 110.182 -179.221 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -56.39 -29.59 77.92 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 C-N-CA 122.701 2.267 . . . . 0.0 110.832 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 18.9 ttm -54.88 -25.25 27.68 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.577 -0.702 . . . . 0.0 109.483 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.43 30.92 2.94 Favored Glycine 0 N--CA 1.497 2.726 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -140.27 124.34 10.7 Favored Pre-proline 0 N--CA 1.493 1.678 0 O-C-N 121.165 -1.197 . . . . 0.0 110.107 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.525 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.7 Cg_endo -65.94 104.16 0.67 Allowed 'Trans proline' 0 C--N 1.314 -1.275 0 C-N-CA 122.143 1.895 . . . . 0.0 109.805 179.293 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.584 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -117.3 127.27 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-O 122.156 0.979 . . . . 0.0 110.731 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 12.0 p -48.97 138.32 11.72 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.726 -0.609 . . . . 0.0 109.594 179.11 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.647 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 1.6 t-20 -44.68 -33.3 1.79 Allowed 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.519 -0.738 . . . . 0.0 110.779 -179.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -54.63 -48.44 72.26 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.088 -1.008 . . . . 0.0 109.584 179.075 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.454 ' SG ' ' HD3' ' A' ' 42' ' ' ARG . 26.8 m -64.18 -39.11 93.31 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.434 -0.791 . . . . 0.0 109.382 179.177 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.54 -28.65 72.09 Favored Glycine 0 N--CA 1.496 2.633 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.649 ' CD1' ' H62' ' C' ' 124' ' ' ' DA' . 42.5 mt -76.91 -70.1 0.48 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.319 -1.107 . . . . 0.0 110.387 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.432 ' CD1' ' C ' ' A' ' 34' ' ' TYR . 7.7 t80 -43.83 -35.59 1.99 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.352 -0.843 . . . . 0.0 109.146 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.541 ' O ' ' HA ' ' A' ' 39' ' ' GLN . 28.6 t80 -58.55 -51.92 67.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.481 -0.762 . . . . 0.0 110.527 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.536 ' HD3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -59.59 -22.43 61.76 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.392 -1.442 . . . . 0.0 110.723 -179.534 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.484 ' N ' ' HG2' ' A' ' 36' ' ' LYS . 1.9 mp -73.73 -69.32 0.44 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.41 -0.806 . . . . 0.0 110.249 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.522 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 35.5 m-70 -100.96 15.08 29.8 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.282 -0.886 . . . . 0.0 110.191 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.541 ' HA ' ' O ' ' A' ' 35' ' ' TYR . 4.4 pm0 36.86 43.88 0.32 Allowed 'General case' 0 N--CA 1.503 2.203 0 CA-C-O 121.547 0.689 . . . . 0.0 111.45 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.428 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.2 m -132.92 178.4 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 O-C-N 121.434 -0.792 . . . . 0.0 109.989 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -70.4 172.95 7.49 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.286 -0.883 . . . . 0.0 110.475 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.454 ' HD3' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -131.83 131.73 22.85 Favored Pre-proline 0 N--CA 1.501 2.123 0 O-C-N 121.306 -0.871 . . . . 0.0 109.226 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.413 ' HB2' HG22 ' A' ' 45' ' ' THR . 3.3 Cg_endo -68.44 146.56 68.77 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 122.492 2.128 . . . . 0.0 111.674 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.486 ' O ' ' HB3' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -92.93 -3.24 54.88 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.617 -0.677 . . . . 0.0 110.061 178.754 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.413 HG22 ' HB2' ' A' ' 43' ' ' PRO . 2.2 t -63.69 -35.78 81.67 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.914 -1.116 . . . . 0.0 110.281 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 5.4 ttt -84.38 8.56 15.79 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.99 -1.069 . . . . 0.0 110.076 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.487 ' CD ' ' O ' ' A' ' 10' ' ' CYS . 0.3 OUTLIER -75.08 157.38 34.85 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.859 -1.15 . . . . 0.0 109.907 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -139.33 146.83 40.77 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.247 -0.908 . . . . 0.0 109.232 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.5 OUTLIER -64.89 -39.15 93.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.859 . . . . 0.0 109.625 179.998 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -98.11 130.66 10.31 Favored Glycine 0 N--CA 1.495 2.632 0 N-CA-C 109.026 -1.629 . . . . 0.0 109.026 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.3 mt -45.93 113.13 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.664 -0.904 . . . . 0.0 109.921 -179.754 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -55.17 149.77 11.91 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.689 -0.632 . . . . 0.0 110.309 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.88 160.94 40.59 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.129 -0.982 . . . . 0.0 109.462 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -151.5 -161.64 1.37 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.655 -0.653 . . . . 0.0 109.858 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -55.99 133.66 51.85 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.074 -1.016 . . . . 0.0 108.949 179.27 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -61.32 158.99 13.17 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 121.607 0.718 . . . . 0.0 110.199 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.41 ' HG2' " H4'" ' B' ' 111' ' ' ' DA' . 6.4 ttmt -82.68 135.43 35.02 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 0.0 110.0 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.6 t -74.54 150.42 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.199 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.4 p -64.56 114.2 4.21 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.067 -1.02 . . . . 0.0 109.007 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.497 1.897 0 O-C-N 121.305 -0.872 . . . . 0.0 109.757 -179.084 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.531 ' N7 ' HD12 ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.443 1.801 0 O4'-C1'-N19 110.647 3.558 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.53 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.871 1 O4'-C1'-N19 111.912 5.14 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.457 ' N6 ' ' N6 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.469 1 O4'-C1'-N19 111.488 4.611 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.519 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.277 1 O4'-C1'-N19 111.284 4.355 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.519 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.889 0 O4'-C1'-N19 110.912 3.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.426 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.857 0 O4'-C1'-N19 110.925 3.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.426 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.931 1 O4'-C1'-N19 111.325 4.407 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.426 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.611 1.81 0 O4'-C1'-N19 110.391 3.239 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.687 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.752 1 O4'-C1'-N19 111.562 4.703 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.687 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.654 1 O4'-C1'-N19 112.087 5.358 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.532 2.657 1 O4'-C1'-N19 111.307 4.384 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.479 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.098 0 O4'-C1'-N19 110.635 3.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.584 ' H62' ' CD1' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.357 0 O4'-C1'-N19 110.584 3.48 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.52 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.532 2.586 1 O4'-C1'-N19 112.515 5.894 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.488 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.063 0 O4'-C1'-N19 110.796 3.744 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.436 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.07 0 O4'-C1'-N19 110.899 3.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 3' ' ' ALA . 5.6 mttt . . . . . 0 N--CA 1.5 2.047 0 N-CA-C 110.427 -0.212 . . . . 0.0 110.427 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.95 90.81 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.48 -0.763 . . . . 0.0 110.665 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.422 ' N ' ' O ' ' A' ' 1' ' ' LYS . . . -64.21 90.98 0.07 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.54 -0.725 . . . . 0.0 109.834 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 53.42 36.64 53.94 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.449 ' O ' ' CH2' ' A' ' 18' ' ' TRP . 25.2 m -55.45 94.54 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.553 -0.969 . . . . 0.0 109.857 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.4 m -89.95 112.31 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.539 ' HB3' HG21 ' A' ' 12' ' ' THR . 38.7 t -44.18 109.44 0.15 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.498 -0.751 . . . . 0.0 110.669 -178.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.7 m -57.73 -20.08 32.12 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.11 -0.994 . . . . 0.0 111.72 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.425 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 9.4 m-20 -85.67 -30.74 22.96 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.951 -1.093 . . . . 0.0 110.786 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.539 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 18.6 p -141.86 24.84 2.0 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.666 -1.271 . . . . 0.0 111.103 179.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.512 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 40.36 26.95 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.786 -0.571 . . . . 0.0 111.936 179.811 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.539 HG21 ' HB3' ' A' ' 7' ' ' CYS . 5.7 t -85.65 130.13 34.65 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.779 -1.201 . . . . 0.0 109.531 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -90.66 6.12 45.21 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.533 -0.73 . . . . 0.0 109.292 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.469 ' HB ' ' CG1' ' A' ' 51' ' ' ILE . 14.5 p -125.82 124.55 41.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.259 -0.901 . . . . 0.0 109.57 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.586 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 9.6 p -145.3 146.44 31.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.036 -1.04 . . . . 0.0 110.387 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.52 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 22.5 p -67.04 -38.54 86.07 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.007 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.531 HD12 ' N7 ' ' B' ' 106' ' ' ' DA' . 11.6 mt -149.86 107.61 3.68 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.586 ' CZ2' HG23 ' A' ' 15' ' ' THR . 40.9 m95 -59.27 94.83 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.515 -0.74 . . . . 0.0 110.262 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.04 87.67 5.42 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.371 -0.83 . . . . 0.0 108.951 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.11 102.8 0.32 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.402 -0.811 . . . . 0.0 109.43 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.1 t -67.59 136.98 93.02 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.351 -0.843 . . . . 0.0 110.169 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -58.98 -30.12 92.45 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 C-N-CA 122.625 2.217 . . . . 0.0 110.924 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -57.67 -24.91 59.15 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.223 -0.923 . . . . 0.0 109.281 179.397 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 113.2 33.9 1.89 Allowed Glycine 0 N--CA 1.496 2.666 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -136.77 109.27 9.25 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.21 -1.171 . . . . 0.0 110.596 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.516 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 5.8 Cg_exo -62.36 102.6 0.28 Allowed 'Trans proline' 0 C--N 1.315 -1.21 0 C-N-CA 122.155 1.903 . . . . 0.0 109.464 178.645 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.466 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -111.69 155.89 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 120.977 -1.077 . . . . 0.0 110.943 -179.345 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.507 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 15.3 p -82.32 139.58 34.06 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -38.04 -44.23 0.79 Allowed 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.762 -0.586 . . . . 0.0 111.413 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.28 -48.62 76.24 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.24 -0.912 . . . . 0.0 111.239 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.452 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 3.6 m -56.29 -49.78 73.29 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.265 -0.897 . . . . 0.0 108.663 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.09 -38.46 93.07 Favored Glycine 0 N--CA 1.494 2.554 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.584 ' CD1' ' H62' ' C' ' 124' ' ' ' DA' . 44.8 mt -67.72 -67.75 0.44 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.492 -1.005 . . . . 0.0 110.13 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 89.4 t80 -52.74 -37.36 59.18 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.445 -0.785 . . . . 0.0 109.256 179.899 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' A' ' 39' ' ' GLN . 43.3 t80 -60.74 -45.65 93.46 Favored 'General case' 0 C--O 1.2 -1.523 0 O-C-N 121.414 -0.804 . . . . 0.0 108.917 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.39 -29.74 61.86 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.194 -1.566 . . . . 0.0 110.06 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.4 mp -64.74 -65.82 0.62 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.945 -1.097 . . . . 0.0 110.122 -179.84 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -94.61 -32.73 13.28 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.228 -0.92 . . . . 0.0 109.977 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.575 ' N ' ' O ' ' A' ' 35' ' ' TYR . 21.7 tt0 72.87 46.09 0.27 Allowed 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 121.734 0.778 . . . . 0.0 110.577 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 m -140.34 167.69 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 121.395 -0.815 . . . . 0.0 109.219 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -85.16 129.88 34.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.065 -1.022 . . . . 0.0 109.036 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -130.17 146.38 61.31 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.188 -0.945 . . . . 0.0 109.882 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.0 144.31 99.48 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 C-N-CA 122.622 2.215 . . . . 0.0 111.314 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.539 ' HB3' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -78.89 48.01 0.8 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.121 -0.987 . . . . 0.0 110.739 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.5 t -66.31 -12.19 55.15 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.133 -0.98 . . . . 0.0 110.141 178.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -103.32 -2.28 27.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.988 -1.07 . . . . 0.0 110.565 179.489 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.491 ' HD3' ' HB2' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -67.1 157.93 32.4 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.631 -1.293 . . . . 0.0 110.256 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.0 mttt -143.51 -163.84 1.74 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.586 -0.696 . . . . 0.0 109.487 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.53 -74.01 0.3 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.211 -0.931 . . . . 0.0 110.015 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.45 161.74 26.44 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.469 ' CG1' ' HB ' ' A' ' 14' ' ' THR . 7.6 mt -55.32 135.43 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.238 -1.154 . . . . 0.0 110.096 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -69.87 150.02 47.24 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.363 -0.836 . . . . 0.0 109.248 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.63 160.85 40.76 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.112 -0.993 . . . . 0.0 109.763 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -151.21 175.96 11.67 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -63.49 93.05 0.07 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.407 ' HD2' ' OP1' ' C' ' 126' ' ' ' DC' . 1.8 ptt180 -47.55 130.22 13.86 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.662 -0.649 . . . . 0.0 110.503 -178.551 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . 0.405 ' CB ' " H4'" ' B' ' 111' ' ' ' DA' . 0.0 OUTLIER -47.28 138.4 7.28 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.688 -0.633 . . . . 0.0 110.069 -179.791 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.2 155.29 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.475 -0.765 . . . . 0.0 110.12 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -46.9 118.72 2.18 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.77 -0.582 . . . . 0.0 110.736 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.1 t . . . . . 0 N--CA 1.497 1.924 0 O-C-N 121.374 -0.829 . . . . 0.0 110.156 179.833 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.537 ' C6 ' ' C6 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.444 1.818 0 O4'-C1'-N19 110.669 3.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.537 ' C6 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.764 1 O4'-C1'-N19 111.565 4.706 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.565 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.104 1 O4'-C1'-N19 111.023 4.028 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.565 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.752 0 O4'-C1'-N19 110.465 3.332 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.49 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.445 1.906 0 O4'-C1'-N19 110.738 3.672 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.411 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.12 0 O4'-C1'-N19 110.94 3.925 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.883 1 O4'-C1'-N19 111.333 4.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.929 0 C3'-C2'-C1' 107.149 3.178 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.683 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.787 1 O4'-C1'-N19 111.361 4.452 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.683 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.476 1 O4'-C1'-N19 111.885 5.106 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.504 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.965 1 O4'-C1'-N19 111.262 4.327 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.527 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.442 1.708 0 O4'-C1'-N19 110.444 3.305 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.527 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.639 0 O4'-C1'-N19 110.791 3.739 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.597 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.933 1 O4'-C1'-N19 111.566 4.708 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.597 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.476 0 O4'-C1'-N19 110.722 3.652 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.454 ' C6 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.552 1 O4'-C1'-N19 111.197 4.247 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 4.1 tttp . . . . . 0 N--CA 1.496 1.861 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -99.27 46.11 0.98 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.945 -1.097 . . . . 0.0 109.651 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.02 114.49 1.96 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.29 -0.881 . . . . 0.0 109.403 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.46 -35.58 2.89 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.477 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 3.5 m -64.68 93.77 0.11 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.282 -1.128 . . . . 0.0 109.094 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.8 m -98.65 137.64 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.573 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 9.4 t -56.16 117.61 3.92 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.47 -0.769 . . . . 0.0 110.659 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -58.52 -16.28 14.78 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.466 -0.771 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.475 ' OD1' ' HD3' ' A' ' 42' ' ' ARG . 4.5 m-80 -109.42 -24.96 10.77 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.923 -1.111 . . . . 0.0 111.569 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.493 ' SG ' HG23 ' A' ' 12' ' ' THR . 4.8 p -140.23 19.82 2.42 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.491 -1.38 . . . . 0.0 111.466 179.491 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 39.24 34.81 0.13 Allowed 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.554 -0.716 . . . . 0.0 112.841 178.066 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.517 HG23 ' HB2' ' A' ' 7' ' ' CYS . 11.0 t -89.18 132.49 34.82 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.61 -1.306 . . . . 0.0 108.822 178.524 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.74 -25.11 18.34 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.471 -0.768 . . . . 0.0 110.191 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.488 ' HB ' HG13 ' A' ' 51' ' ' ILE . 68.9 p -103.88 114.8 29.32 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.167 -0.958 . . . . 0.0 109.209 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.2 p -130.4 161.55 31.1 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 119.664 -0.814 . . . . 0.0 110.594 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.493 ' CG2' " H3'" ' C' ' 124' ' ' ' DA' . 6.4 p -82.8 -36.46 25.56 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.522 ' CD1' ' N6 ' ' B' ' 108' ' ' ' DA' . 17.8 mt -143.05 106.09 4.54 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.477 ' CZ2' HG23 ' A' ' 5' ' ' THR . 16.3 m95 -64.27 107.21 1.26 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.373 -0.829 . . . . 0.0 110.391 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.557 ' HB3' HG21 ' A' ' 27' ' ' VAL . 6.8 tpt180 -81.66 72.97 8.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 108.719 179.196 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.439 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 10.7 tpp180 -63.52 92.42 0.06 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.0 143.79 91.51 Favored Pre-proline 0 N--CA 1.499 1.979 0 O-C-N 121.338 -0.851 . . . . 0.0 110.354 -178.629 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -54.5 -42.56 66.94 Favored 'Trans proline' 0 C--N 1.32 -0.967 0 C-N-CA 122.632 2.221 . . . . 0.0 111.09 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -21.16 58.58 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.283 -0.886 . . . . 0.0 109.972 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.34 42.13 1.19 Allowed Glycine 0 N--CA 1.497 2.719 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -128.7 92.82 39.28 Favored Pre-proline 0 N--CA 1.493 1.687 0 O-C-N 121.373 -1.075 . . . . 0.0 110.091 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.492 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.3 Cg_endo -64.35 95.2 0.21 Allowed 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 122.51 2.14 . . . . 0.0 110.003 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.573 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.05 123.26 69.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.071 -1.018 . . . . 0.0 110.655 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.5 p -45.63 132.62 8.36 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.27 -0.894 . . . . 0.0 109.947 179.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 6.4 t-20 -37.48 -42.45 0.52 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.61 -0.681 . . . . 0.0 111.825 -178.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.477 ' HB1' ' OP2' ' C' ' 124' ' ' ' DA' . . . -49.78 -46.29 50.58 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.24 -0.913 . . . . 0.0 110.217 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.408 ' HA ' ' HG2' ' A' ' 42' ' ' ARG . 33.0 m -66.75 -33.61 76.02 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.327 -0.858 . . . . 0.0 109.352 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.01 -38.61 95.66 Favored Glycine 0 N--CA 1.493 2.468 0 N-CA-C 109.156 -1.577 . . . . 0.0 109.156 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.497 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 95.2 mt -73.09 -58.01 3.62 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.526 -0.985 . . . . 0.0 110.045 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.414 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 29.6 t80 -46.14 -37.34 6.82 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.198 -0.938 . . . . 0.0 109.559 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.518 ' O ' ' N ' ' A' ' 39' ' ' GLN . 18.5 t80 -60.7 -55.42 33.4 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.37 -0.831 . . . . 0.0 110.413 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.497 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -57.29 -24.1 52.74 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.575 -1.328 . . . . 0.0 110.802 -179.556 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.463 HD13 ' HG3' ' A' ' 36' ' ' LYS . 5.7 mp -65.3 -67.19 0.46 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.345 -0.847 . . . . 0.0 109.823 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.519 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 66.1 m-70 -97.16 -29.5 13.56 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.295 -0.878 . . . . 0.0 110.395 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.519 ' CG ' ' O ' ' A' ' 38' ' ' HIS . 0.1 OUTLIER 87.4 27.5 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.571 0 CA-C-O 121.609 0.719 . . . . 0.0 110.574 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 m -124.63 -171.0 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.078 -1.014 . . . . 0.0 109.629 179.05 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.17 175.64 0.21 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.058 -1.027 . . . . 0.0 109.378 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.475 ' HD3' ' OD1' ' A' ' 9' ' ' ASN . 1.6 mpt_? -119.8 132.86 23.9 Favored Pre-proline 0 N--CA 1.495 1.804 0 O-C-N 120.909 -1.119 . . . . 0.0 109.805 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -62.8 126.32 17.9 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 C-N-CA 122.39 2.06 . . . . 0.0 110.965 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.433 ' HB3' ' HA ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -94.16 -19.72 20.52 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.422 -0.799 . . . . 0.0 110.123 179.521 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.22 -34.33 70.3 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.218 -0.926 . . . . 0.0 110.423 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -74.74 -29.81 61.29 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.243 -0.911 . . . . 0.0 109.482 179.506 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.49 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -64.16 141.75 58.66 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.365 -0.835 . . . . 0.0 109.34 179.795 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 tttt -104.42 178.27 4.61 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.282 -0.886 . . . . 0.0 110.15 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -74.94 -33.69 61.98 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.338 -0.852 . . . . 0.0 110.265 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -114.09 149.03 18.77 Favored Glycine 0 N--CA 1.497 2.757 0 N-CA-C 109.079 -1.609 . . . . 0.0 109.079 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.488 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.2 mt -46.35 107.77 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.545 -0.974 . . . . 0.0 110.128 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -52.3 147.59 7.67 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.34 161.75 40.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.49 -1.381 . . . . 0.0 109.984 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.46 -152.37 0.43 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -60.02 114.31 2.77 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.808 -1.182 . . . . 0.0 107.944 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -47.17 133.71 11.59 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.665 -0.647 . . . . 0.0 109.864 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -50.11 106.9 0.13 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 3.6 m -55.67 152.65 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.544 -0.722 . . . . 0.0 110.053 -178.783 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.77 74.88 0.6 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.435 -0.791 . . . . 0.0 109.579 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 N--CA 1.498 1.97 0 O-C-N 121.309 -0.87 . . . . 0.0 109.262 179.899 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.558 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.445 1.931 0 O4'-C1'-N19 110.818 3.772 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.558 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.441 1.634 1 O4'-C1'-N19 111.44 4.55 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.587 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.019 1 O4'-C1'-N19 111.07 4.088 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.587 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.039 1 O4'-C1'-N19 111.347 4.434 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.539 ' C2 ' ' C2 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.732 1 O4'-C1'-N19 111.024 4.03 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.539 ' C2 ' ' C2 ' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.921 0 O4'-C1'-N19 110.83 3.787 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.421 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.028 1 O4'-C1'-N19 111.206 4.258 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.421 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.613 2.048 0 O4'-C1'-N19 110.72 3.651 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.664 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.968 1 O4'-C1'-N19 111.83 5.037 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.664 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.577 1 O4'-C1'-N19 112.275 5.594 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.405 " O5'" H2'' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.16 1 O4'-C1'-N19 112.164 5.455 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.487 ' OP2' ' HB2' ' A' ' 34' ' ' TYR . . . . . . . . 0 C5'--C4' 1.529 2.236 0 O4'-C1'-N19 110.54 3.426 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.557 ' H62' ' CD1' ' A' ' 33' ' ' LEU . . . . . . . . 0 O4'--C1' 1.445 1.922 1 O4'-C1'-N19 111.476 4.595 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.589 ' H73' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.527 1.981 1 O4'-C1'-N19 112.11 5.387 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.565 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.642 0 O4'-C1'-N19 110.852 3.815 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.908 0 O4'-C1'-N19 110.688 3.611 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.712 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 -90.21 59.82 4.57 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.41 -0.806 . . . . 0.0 109.76 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.49 140.53 58.61 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.324 -0.86 . . . . 0.0 109.419 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.79 -30.38 9.84 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.221 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 92.7 m -72.61 89.1 1.29 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.188 -1.183 . . . . 0.0 109.579 179.555 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 32.7 m -85.61 122.13 38.04 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 179.236 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.492 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 53.4 t -56.02 113.9 1.71 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.932 -1.105 . . . . 0.0 110.05 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -60.8 -12.96 12.41 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.366 -0.833 . . . . 0.0 111.24 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -99.13 -31.22 11.86 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.82 -1.175 . . . . 0.0 110.702 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.487 ' SG ' ' HD3' ' A' ' 47' ' ' ARG . 15.0 p -139.42 24.26 2.48 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.56 -1.338 . . . . 0.0 111.424 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 43.04 23.9 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.215 -0.928 . . . . 0.0 112.71 178.593 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.488 HG23 ' HB2' ' A' ' 7' ' ' CYS . 5.5 t -86.83 132.1 33.93 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.373 -1.454 . . . . 0.0 110.236 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.35 -25.62 19.31 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.4 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.6 p -97.39 117.58 31.94 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.326 -0.859 . . . . 0.0 109.374 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.488 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 18.0 p -132.43 156.04 47.42 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.157 -0.965 . . . . 0.0 111.004 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.589 ' HB ' ' H73' ' C' ' 125' ' ' ' DT' . 28.6 p -83.22 -40.93 18.99 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.569 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 16.6 mt -139.56 92.36 2.56 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 179.475 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.488 ' CZ2' HG23 ' A' ' 15' ' ' THR . 10.5 m95 -57.6 127.97 34.72 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.195 -0.94 . . . . 0.0 110.148 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -116.16 86.07 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.379 -0.826 . . . . 0.0 109.122 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.454 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 12.8 mmm180 -62.63 102.73 0.36 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.371 -0.831 . . . . 0.0 109.314 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.481 ' HB2' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -63.65 143.57 97.95 Favored Pre-proline 0 N--CA 1.498 1.941 0 O-C-N 121.165 -0.959 . . . . 0.0 110.263 -179.292 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -53.99 -44.01 53.11 Favored 'Trans proline' 0 C--N 1.318 -1.03 0 C-N-CA 122.866 2.377 . . . . 0.0 111.26 -179.141 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -22.12 45.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.313 -0.867 . . . . 0.0 109.941 179.376 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.0 38.35 1.41 Allowed Glycine 0 N--CA 1.497 2.759 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 21' ' ' SER . 15.8 m-20 -128.51 98.21 26.13 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.324 -1.104 . . . . 0.0 110.082 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.485 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.9 Cg_endo -64.83 101.5 0.39 Allowed 'Trans proline' 0 C--N 1.311 -1.411 0 C-N-CA 121.956 1.771 . . . . 0.0 109.866 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.492 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -115.01 126.29 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.209 -0.932 . . . . 0.0 110.281 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.8 p -50.4 135.69 21.69 Favored 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.698 -0.626 . . . . 0.0 109.421 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.569 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t-20 -38.17 -43.81 0.8 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.564 -0.71 . . . . 0.0 111.384 -178.968 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.425 ' CB ' ' OP2' ' C' ' 124' ' ' ' DA' . . . -48.15 -45.31 33.12 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.525 -0.735 . . . . 0.0 110.359 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.509 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 51.3 m -70.3 -35.45 73.71 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.436 -0.79 . . . . 0.0 109.556 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.77 -31.73 81.87 Favored Glycine 0 N--CA 1.496 2.658 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.557 ' CD1' ' H62' ' C' ' 124' ' ' ' DA' . 96.8 mt -79.25 -61.22 2.08 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.248 -1.148 . . . . 0.0 110.079 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.556 ' CE2' ' HB2' ' A' ' 42' ' ' ARG . 33.1 t80 -50.79 -36.03 34.94 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.379 -0.826 . . . . 0.0 108.886 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.561 ' O ' ' N ' ' A' ' 39' ' ' GLN . 18.5 t80 -59.45 -53.68 55.34 Favored 'General case' 0 C--O 1.199 -1.559 0 O-C-N 121.54 -0.725 . . . . 0.0 109.669 179.26 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.506 ' HD3' HD11 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -55.02 -27.41 44.19 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 119.918 -1.739 . . . . 0.0 110.267 179.616 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.506 HD11 ' HD3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -66.57 -71.14 0.21 Allowed 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.896 -1.128 . . . . 0.0 109.92 179.614 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -96.19 -28.6 14.48 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.204 -0.935 . . . . 0.0 109.56 179.734 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.561 ' N ' ' O ' ' A' ' 35' ' ' TYR . 21.5 tt0 73.3 52.43 0.13 Allowed 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 122.163 0.983 . . . . 0.0 110.336 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.3 m -141.34 170.49 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.099 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -78.54 126.04 30.2 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.814 -1.179 . . . . 0.0 109.981 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.556 ' HB2' ' CE2' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -102.57 131.86 21.94 Favored Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.037 -1.04 . . . . 0.0 109.77 -179.55 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -64.51 150.66 87.85 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.283 1.989 . . . . 0.0 110.334 178.967 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.461 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -84.67 30.77 0.55 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.002 -1.061 . . . . 0.0 110.406 179.699 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 33.8 p -70.68 -17.14 62.85 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.129 -0.982 . . . . 0.0 109.948 179.498 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.56 1.68 51.57 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.987 -1.071 . . . . 0.0 110.428 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -79.05 166.45 22.3 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 120.807 -1.183 . . . . 0.0 109.706 179.655 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 tptt -134.42 -172.55 3.04 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.36 -0.837 . . . . 0.0 109.469 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -59.85 -50.71 72.72 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.309 -0.869 . . . . 0.0 110.027 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.11 171.77 15.82 Favored Glycine 0 N--CA 1.494 2.501 0 N-CA-C 109.446 -1.462 . . . . 0.0 109.446 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.409 ' CG2' HG23 ' A' ' 16' ' ' THR . 5.3 mt -49.55 125.72 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.488 -1.007 . . . . 0.0 109.995 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.487 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.1 OUTLIER -71.25 154.81 41.36 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.554 -0.716 . . . . 0.0 110.203 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.454 ' HB ' ' OP1' ' C' ' 125' ' ' ' DT' . 0.1 OUTLIER -156.32 154.08 30.04 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.843 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.458 ' HG2' ' NH1' ' A' ' 54' ' ' ARG . 0.4 OUTLIER -151.67 -164.94 2.1 Favored 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -65.57 89.74 0.11 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.995 -1.066 . . . . 0.0 108.158 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.516 ' HD2' " O3'" ' C' ' 125' ' ' ' DT' . 0.5 OUTLIER -64.77 175.52 1.45 Allowed 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.564 0.697 . . . . 0.0 110.365 -178.903 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt -56.88 111.13 0.94 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.626 -0.671 . . . . 0.0 109.608 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.7 p -52.34 146.65 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.7 t -47.47 120.27 3.17 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.178 -0.952 . . . . 0.0 110.378 -179.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.1 t . . . . . 0 N--CA 1.496 1.875 0 O-C-N 121.702 -0.624 . . . . 0.0 110.082 -179.791 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.581 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.895 0 O4'-C1'-N19 110.521 3.401 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.581 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.875 1 O4'-C1'-N19 111.43 4.537 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.62 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.892 0 O4'-C1'-N19 110.892 3.865 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.62 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.805 1 O4'-C1'-N19 111.238 4.297 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.585 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.611 1.803 0 O4'-C1'-N19 110.64 3.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.795 0 O4'-C1'-N19 110.952 3.94 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.46 " O3'" ' HD3' ' A' ' 54' ' ' ARG . . . . . . . . 0 P--O5' 1.61 1.722 1 O4'-C1'-N19 111.4 4.5 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.814 0 O4'-C1'-N19 110.402 3.252 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.667 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.927 0 O4'-C1'-N19 110.831 3.789 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.667 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.615 1 O4'-C1'-N19 111.945 5.181 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.431 ' OP2' ' CD2' ' A' ' 37' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.165 1 O4'-C1'-N19 111.096 4.12 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.452 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.339 0 O4'-C1'-N19 110.633 3.541 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.452 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.473 0 O4'-C1'-N19 110.541 3.427 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.625 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.415 1 O4'-C1'-N19 112.651 6.064 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.496 " H2'" ' C5 ' ' C' ' 127' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.62 0 O4'-C1'-N19 110.828 3.785 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.496 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.899 0 O4'-C1'-N19 110.894 3.868 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.8 tttt . . . . . 0 N--CA 1.498 1.962 0 CA-C-O 121.053 0.454 . . . . 0.0 110.349 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.467 ' NE ' ' HA ' ' A' ' 2' ' ' ARG . 1.4 mmp_? -100.59 -13.57 18.54 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.919 -1.113 . . . . 0.0 109.916 179.303 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.26 111.21 3.86 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.1 -1.0 . . . . 0.0 108.986 179.321 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.22 -14.77 6.52 Favored Glycine 0 N--CA 1.497 2.729 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 -179.082 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.503 HG22 ' CH2' ' A' ' 18' ' ' TRP . 4.3 m -62.81 89.36 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.085 -1.244 . . . . 0.0 109.631 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 35.0 m -82.48 114.27 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.481 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.538 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 45.3 t -49.35 110.08 0.33 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.253 -0.904 . . . . 0.0 110.468 -178.701 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.2 m -60.37 -13.22 11.99 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.171 -0.955 . . . . 0.0 111.149 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.494 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 1.0 OUTLIER -92.54 -30.96 15.39 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.822 -1.174 . . . . 0.0 110.69 -179.654 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.503 ' SG ' ' HD2' ' A' ' 47' ' ' ARG . 16.9 p -141.82 24.87 2.0 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.932 -1.105 . . . . 0.0 111.175 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 42.67 27.61 0.1 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.308 -0.87 . . . . 0.0 112.229 179.085 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.503 HG22 ' CB ' ' A' ' 7' ' ' CYS . 6.9 t -89.88 127.49 36.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.657 -1.277 . . . . 0.0 109.975 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -90.71 -12.59 36.19 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.534 -0.729 . . . . 0.0 109.63 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.424 ' HB ' HG13 ' A' ' 51' ' ' ILE . 30.0 p -113.35 126.1 55.0 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.213 -0.93 . . . . 0.0 108.576 179.219 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.545 HG21 ' CZ2' ' A' ' 18' ' ' TRP . 20.3 p -139.96 160.85 38.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.13 -0.981 . . . . 0.0 110.228 -179.238 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.625 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 44.6 p -91.67 -26.1 18.81 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.526 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.667 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 63.4 mt -144.09 87.45 1.9 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 179.506 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.545 ' CZ2' HG21 ' A' ' 15' ' ' THR . 6.0 m95 -57.44 106.72 0.36 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.075 -1.016 . . . . 0.0 110.543 -179.327 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.0 92.39 4.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.328 -0.858 . . . . 0.0 109.559 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.474 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 2.0 tmt_? -72.76 126.53 30.13 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.118 -0.989 . . . . 0.0 109.729 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.0 t -90.17 140.42 27.31 Favored Pre-proline 0 N--CA 1.497 1.906 0 O-C-N 121.334 -0.854 . . . . 0.0 109.782 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -55.89 -36.04 94.97 Favored 'Trans proline' 0 C--N 1.32 -0.944 0 C-N-CA 122.582 2.188 . . . . 0.0 110.908 -179.563 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.4 ttt -51.45 -24.9 5.51 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.517 -0.739 . . . . 0.0 109.833 178.906 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . 0.438 ' HA2' ' CZ ' ' A' ' 20' ' ' ARG . . . 111.22 28.51 3.8 Favored Glycine 0 N--CA 1.496 2.673 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 179.892 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -133.48 104.76 12.09 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.21 -1.17 . . . . 0.0 110.419 -179.574 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.474 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 2.8 Cg_endo -64.0 117.88 4.86 Favored 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.127 1.885 . . . . 0.0 109.66 178.674 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.538 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -127.58 125.24 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.055 -1.028 . . . . 0.0 110.64 -179.625 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.448 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 8.0 p -51.53 131.61 29.49 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 179.261 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.667 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 23.8 t-20 -39.63 -38.5 0.62 Allowed 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.633 -0.667 . . . . 0.0 111.34 -178.931 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.23 -43.27 61.42 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.255 -0.903 . . . . 0.0 110.279 179.565 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.494 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 12.5 m -66.92 -44.6 80.31 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.126 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.54 -31.28 77.1 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 179.128 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.45 ' O ' HD13 ' A' ' 37' ' ' LEU . 48.5 mt -72.83 -67.61 0.55 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.331 -1.1 . . . . 0.0 110.047 -179.564 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.409 ' CE1' ' CD2' ' A' ' 38' ' ' HIS . 62.4 t80 -49.6 -35.01 19.47 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.399 -0.813 . . . . 0.0 109.638 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.514 ' O ' ' N ' ' A' ' 39' ' ' GLN . 13.1 t80 -61.5 -51.45 68.6 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.389 -0.819 . . . . 0.0 109.877 179.439 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -55.02 -26.34 36.5 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.28 -1.512 . . . . 0.0 110.567 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.45 HD13 ' O ' ' A' ' 33' ' ' LEU . 5.0 mp -72.96 -65.16 0.83 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.098 -1.001 . . . . 0.0 110.719 -179.308 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.428 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 26.2 m-70 -97.76 -27.19 14.44 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.325 -0.859 . . . . 0.0 110.213 -179.471 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.514 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 77.22 31.75 0.48 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-O 121.652 0.739 . . . . 0.0 110.779 179.876 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.428 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.6 m -121.33 175.7 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 120.911 -1.118 . . . . 0.0 109.48 178.564 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -60.82 167.92 2.57 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.164 -0.96 . . . . 0.0 110.395 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.458 ' HD3' ' HD2' ' A' ' 43' ' ' PRO . 6.5 tpp180 -135.57 103.9 10.17 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.04 -1.038 . . . . 0.0 109.462 179.907 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.458 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 6.1 Cg_exo -57.26 137.84 83.51 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 C-N-CA 122.095 1.863 . . . . 0.0 110.229 179.657 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.528 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -79.56 6.94 9.22 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.428 -0.795 . . . . 0.0 111.013 -179.608 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.7 p -56.97 -20.32 23.1 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.979 -1.075 . . . . 0.0 110.392 179.252 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -82.55 -10.04 59.15 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.949 -1.095 . . . . 0.0 110.111 179.239 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.528 ' HG3' ' HB2' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -80.42 155.91 26.89 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.88 -1.138 . . . . 0.0 109.651 -179.971 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.426 ' HA ' ' HD2' ' A' ' 48' ' ' LYS . 5.5 mmmt -125.39 -156.86 0.75 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.216 -0.928 . . . . 0.0 109.489 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -51.25 -53.08 38.83 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.174 -0.954 . . . . 0.0 109.719 179.801 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -139.91 -168.32 11.29 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 179.533 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.424 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.1 mt -53.75 125.36 7.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.403 -1.057 . . . . 0.0 110.063 179.92 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -66.32 142.69 57.56 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.409 -0.807 . . . . 0.0 109.427 179.322 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.39 164.22 36.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.991 -1.068 . . . . 0.0 109.771 179.578 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.46 ' HD3' " O3'" ' B' ' 112' ' ' ' DA' . 0.0 OUTLIER -151.79 -165.44 2.23 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -179.59 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -54.27 116.27 2.52 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.052 -1.03 . . . . 0.0 108.712 179.107 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -45.05 135.64 5.29 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.585 -0.697 . . . . 0.0 110.607 -178.9 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -62.16 145.47 53.36 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.43 -0.793 . . . . 0.0 109.915 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.3 t -60.9 147.42 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.513 -0.742 . . . . 0.0 109.803 179.772 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.3 152.56 10.93 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.488 -0.757 . . . . 0.0 110.226 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 p . . . . . 0 N--CA 1.494 1.771 0 O-C-N 121.34 -0.85 . . . . 0.0 110.411 -179.451 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.601 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.614 2.14 0 O4'-C1'-N19 110.711 3.639 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.601 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.87 1 O4'-C1'-N19 112.025 5.282 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.617 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.217 1 O4'-C1'-N19 111.146 4.182 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.617 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.122 1 O4'-C1'-N19 111.23 4.288 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.555 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.798 0 O4'-C1'-N19 110.885 3.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.427 " O5'" H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.793 0 O4'-C1'-N19 110.995 3.994 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.816 1 O4'-C1'-N19 111.438 4.548 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.42 ' OP1' ' HD3' ' A' ' 54' ' ' ARG . . . . . . . . 0 P--O5' 1.611 1.844 0 O4'-C1'-N19 110.473 3.342 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.681 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.963 1 O4'-C1'-N19 111.336 4.42 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.681 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.649 1 O4'-C1'-N19 111.869 5.087 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.511 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.559 1 O4'-C1'-N19 111.411 4.513 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.511 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.185 0 O4'-C1'-N19 110.511 3.389 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.457 " H3'" ' CG2' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.534 2.863 0 O4'-C1'-N19 110.468 3.334 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.634 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.471 1 O4'-C1'-N19 112.566 5.958 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.489 " H2'" ' C5 ' ' C' ' 127' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.767 0 O4'-C1'-N19 110.78 3.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.489 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.471 0 O4'-C1'-N19 110.896 3.871 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.811 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 . . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.34 43.77 1.16 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.027 -1.046 . . . . 0.0 109.617 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.3 153.76 14.75 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.36 -0.838 . . . . 0.0 109.645 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.99 -40.37 2.54 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.239 -1.944 . . . . 0.0 108.239 -178.539 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.455 HG22 ' CE2' ' A' ' 18' ' ' TRP . 54.4 m -80.63 89.21 5.7 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.381 -1.07 . . . . 0.0 109.471 179.043 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.1 m -101.59 131.26 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.498 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 33.6 t -47.63 114.98 1.0 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.544 -0.722 . . . . 0.0 111.0 -179.122 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.1 m -59.69 -13.48 10.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.087 -1.008 . . . . 0.0 110.323 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -102.51 -32.06 10.12 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.822 -1.174 . . . . 0.0 110.931 -179.814 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.463 ' HB2' ' HA ' ' A' ' 44' ' ' LEU . 13.0 p -140.63 23.34 2.3 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.602 -1.312 . . . . 0.0 111.581 -179.532 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 38.75 29.45 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.495 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 178.675 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.495 ' HB ' ' HG3' ' A' ' 47' ' ' ARG . 15.3 t -86.69 132.7 33.8 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.669 -1.269 . . . . 0.0 109.403 178.981 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.4 p -89.31 -28.83 19.6 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.565 -0.709 . . . . 0.0 109.34 179.745 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 23.2 p -90.18 108.36 19.7 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.839 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.486 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 14.6 p -127.08 144.36 51.05 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.161 -0.962 . . . . 0.0 109.937 -179.527 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.634 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 30.9 p -65.96 -36.27 82.87 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.122 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.506 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -149.08 120.31 7.81 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.055 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.486 ' CZ2' HG23 ' A' ' 15' ' ' THR . 9.6 m95 -73.6 95.32 2.28 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.454 -0.779 . . . . 0.0 109.808 -179.452 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 77.11 2.3 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.403 -0.811 . . . . 0.0 108.82 179.629 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.426 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.5 mmt180 -61.19 95.3 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.454 -0.779 . . . . 0.0 109.059 -179.795 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.2 144.31 94.69 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.394 -0.816 . . . . 0.0 109.967 -179.162 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -58.69 -20.91 53.18 Favored 'Trans proline' 0 C--N 1.32 -0.973 0 C-N-CA 122.47 2.113 . . . . 0.0 110.672 179.85 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.8 0.04 25.31 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.18 -0.95 . . . . 0.0 109.9 178.978 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.66 32.57 15.15 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 109.433 -1.467 . . . . 0.0 109.433 -179.48 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -129.51 96.59 26.93 Favored Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 121.443 -1.034 . . . . 0.0 110.553 -179.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.498 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.6 Cg_endo -64.16 111.38 1.58 Allowed 'Trans proline' 0 C--N 1.314 -1.244 0 C-N-CA 122.223 1.949 . . . . 0.0 110.172 178.89 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.498 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -121.45 124.77 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.418 -0.801 . . . . 0.0 110.078 179.896 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.435 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 5.0 p -48.46 135.7 13.76 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.589 -0.694 . . . . 0.0 109.886 179.663 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.506 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 4.6 t-20 -37.04 -44.51 0.53 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.62 -0.675 . . . . 0.0 112.2 -178.608 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.66 -51.92 34.64 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.421 -0.8 . . . . 0.0 110.235 -179.703 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.401 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 63.6 m -63.63 -39.54 94.6 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.301 -0.875 . . . . 0.0 109.537 179.665 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.0 -36.13 91.8 Favored Glycine 0 N--CA 1.498 2.806 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 179.663 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.471 HD13 ' C5 ' ' C' ' 123' ' ' ' DT' . 85.7 mt -73.21 -66.55 0.67 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.395 -1.062 . . . . 0.0 109.985 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.605 ' CD1' ' HB2' ' A' ' 42' ' ' ARG . 8.3 t80 -49.11 -40.44 32.18 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.235 -0.916 . . . . 0.0 109.114 179.628 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.465 ' O ' ' N ' ' A' ' 39' ' ' GLN . 38.2 t80 -51.0 -48.63 61.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.633 -0.667 . . . . 0.0 109.405 179.486 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.39 -38.46 87.57 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.065 -1.022 . . . . 0.0 110.248 179.617 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.482 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 5.1 mp -41.08 -51.37 3.37 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.507 -0.745 . . . . 0.0 110.197 -179.577 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.527 ' HB2' ' CG2' ' A' ' 40' ' ' VAL . 4.1 m-70 -127.91 17.73 6.74 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.27 -0.893 . . . . 0.0 109.555 179.298 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.465 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.3 OUTLIER 47.22 46.77 16.66 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.817 0.817 . . . . 0.0 109.597 -178.989 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.527 ' CG2' ' HB2' ' A' ' 38' ' ' HIS . 3.8 m -133.6 164.36 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 O-C-N 121.41 -0.806 . . . . 0.0 109.963 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -77.97 163.06 26.3 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.431 -0.793 . . . . 0.0 110.351 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.605 ' HB2' ' CD1' ' A' ' 34' ' ' TYR . 4.4 tpt180 -130.14 121.02 19.44 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.222 -0.924 . . . . 0.0 109.222 179.289 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.02 147.0 91.82 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 C-N-CA 121.925 1.75 . . . . 0.0 110.432 179.807 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.463 ' HA ' ' HB2' ' A' ' 10' ' ' CYS . 1.7 pt? -63.08 -10.99 16.62 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.442 -0.786 . . . . 0.0 110.921 179.588 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.9 t -48.73 -31.07 6.32 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.208 -0.933 . . . . 0.0 110.824 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.3 ttt -80.68 -39.66 26.83 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.162 -0.961 . . . . 0.0 109.426 179.656 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.495 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.8 OUTLIER -61.8 129.21 39.92 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.111 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.16 -149.56 0.36 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.281 -0.887 . . . . 0.0 109.685 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -50.63 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.433 -0.792 . . . . 0.0 110.899 -179.182 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.02 -168.45 13.1 Favored Glycine 0 N--CA 1.495 2.587 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 -179.752 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 13.9 mt -48.05 129.53 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.606 -0.938 . . . . 0.0 110.455 -179.772 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -76.36 78.68 3.11 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.3 -0.875 . . . . 0.0 109.861 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.47 161.15 26.25 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.401 -0.812 . . . . 0.0 109.638 179.591 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.42 ' HD3' ' OP1' ' B' ' 113' ' ' ' DC' . 0.4 OUTLIER -150.77 -153.63 0.5 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.61 -0.681 . . . . 0.0 109.767 -179.501 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -74.97 128.94 36.75 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.06 -1.025 . . . . 0.0 108.724 179.031 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.59 133.64 10.1 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.586 -0.696 . . . . 0.0 110.643 -179.349 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt -60.66 140.62 57.4 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.366 -0.834 . . . . 0.0 109.497 179.801 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 10.3 p -65.06 122.5 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.095 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.16 109.2 0.62 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.16 -0.962 . . . . 0.0 108.808 -179.822 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.496 1.852 0 O-C-N 121.336 -0.852 . . . . 0.0 109.997 -179.087 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.564 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.672 0 O4'-C1'-N19 110.532 3.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.564 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.564 1 O4'-C1'-N19 111.908 5.135 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.664 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.004 1 O4'-C1'-N19 111.089 4.112 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.664 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.704 0 O4'-C1'-N19 110.971 3.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.475 H2'' ' C8 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.752 0 O4'-C1'-N19 110.675 3.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.475 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.827 0 O4'-C1'-N19 110.858 3.822 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.461 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.807 1 O4'-C1'-N19 111.468 4.585 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.461 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.737 0 C3'-C2'-C1' 107.26 3.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.696 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.833 0 O4'-C1'-N19 110.887 3.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.696 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.572 1 O4'-C1'-N19 111.957 5.196 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.376 0 O4'-C1'-N19 110.943 3.929 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.528 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.537 0 O4'-C1'-N19 110.61 3.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.528 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.235 1 O4'-C1'-N19 111.346 4.433 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.587 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.472 1 O4'-C1'-N19 112.059 5.324 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.465 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.728 0 O4'-C1'-N19 110.868 3.835 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.258 1 O4'-C1'-N19 111.364 4.455 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.1 tttm . . . . . 0 N--CA 1.498 1.931 0 CA-C-O 121.243 0.544 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.3 tpm_? -64.11 -25.18 67.98 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.001 -1.062 . . . . 0.0 109.155 179.253 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.1 129.44 39.98 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.447 -0.783 . . . . 0.0 108.982 178.908 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.53 -33.54 3.58 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 -179.058 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.476 HG23 ' CD2' ' A' ' 18' ' ' TRP . 27.2 m -62.77 90.75 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.32 -1.106 . . . . 0.0 108.787 178.95 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . 0.404 HG21 ' O ' ' A' ' 6' ' ' VAL . 9.5 m -84.96 112.66 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.069 -1.019 . . . . 0.0 108.379 -179.975 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.505 ' O ' ' N ' ' A' ' 11' ' ' GLN . 44.8 t -47.45 113.7 0.74 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.428 -0.795 . . . . 0.0 109.917 -179.157 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 62.0 m -66.68 -12.56 58.86 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.021 -1.049 . . . . 0.0 111.001 -179.247 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.405 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.9 OUTLIER -89.62 -31.31 17.61 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.84 -1.162 . . . . 0.0 110.228 179.879 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.441 ' SG ' ' CG2' ' A' ' 12' ' ' THR . 16.8 p -140.46 17.4 2.38 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.887 -1.133 . . . . 0.0 111.057 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 7' ' ' CYS . 11.5 mt-30 51.49 21.2 1.19 Allowed 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.989 -1.069 . . . . 0.0 111.801 178.949 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.441 ' CG2' ' SG ' ' A' ' 10' ' ' CYS . 6.3 t -87.61 136.47 32.93 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.681 -1.262 . . . . 0.0 110.564 -179.724 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -27.12 18.93 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.302 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.472 HG21 ' HA2' ' A' ' 50' ' ' GLY . 18.6 p -90.06 127.09 35.99 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.416 -0.802 . . . . 0.0 109.537 179.527 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.587 HG23 ' CZ3' ' A' ' 18' ' ' TRP . 10.3 p -145.69 144.09 30.18 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.409 -0.807 . . . . 0.0 110.225 -179.558 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.587 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 20.2 p -72.63 -28.59 62.85 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.329 -0.857 . . . . 0.0 109.098 179.139 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -152.71 117.17 4.98 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.173 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.587 ' CZ3' HG23 ' A' ' 15' ' ' THR . 8.0 m95 -73.82 108.81 6.87 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.183 -0.948 . . . . 0.0 110.09 -179.02 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -99.3 94.47 6.48 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.133 -0.979 . . . . 0.0 109.452 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.432 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.3 tpp180 -66.6 102.71 0.95 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 108.364 179.364 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.432 ' HB2' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -56.36 146.74 51.62 Favored Pre-proline 0 N--CA 1.5 2.052 0 O-C-N 121.388 -0.82 . . . . 0.0 110.209 -178.718 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -52.92 -43.91 52.82 Favored 'Trans proline' 0 C--N 1.319 -0.995 0 C-N-CA 122.702 2.268 . . . . 0.0 111.07 -179.05 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.6 ttp -57.59 -23.49 51.11 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.414 -0.804 . . . . 0.0 109.717 179.137 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.35 38.22 1.38 Allowed Glycine 0 N--CA 1.496 2.665 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . 0.432 ' O ' ' HB2' ' A' ' 21' ' ' SER . 60.5 m-20 -128.3 110.09 19.54 Favored Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.1 -1.236 . . . . 0.0 110.491 -179.841 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.468 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 3.5 Cg_exo -62.92 109.86 1.01 Allowed 'Trans proline' 0 C--N 1.313 -1.313 0 C-N-CA 122.011 1.807 . . . . 0.0 110.062 178.627 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.422 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.1 m -121.56 131.38 73.21 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.163 -0.961 . . . . 0.0 110.407 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.471 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.8 p -55.03 132.55 47.4 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.663 -0.648 . . . . 0.0 109.305 179.556 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 16.7 t-20 -35.58 -46.09 0.39 Allowed 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.87 -0.519 . . . . 0.0 112.162 -178.313 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.77 -45.46 59.0 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.347 -0.845 . . . . 0.0 110.206 -179.688 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.408 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 19.4 m -65.53 -39.34 91.68 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.177 -0.952 . . . . 0.0 109.001 179.263 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.22 -43.39 95.45 Favored Glycine 0 N--CA 1.497 2.743 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.492 HD12 ' OD1' ' A' ' 29' ' ' ASN . 46.6 mt -75.69 -57.46 3.87 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.454 -1.027 . . . . 0.0 109.698 -179.831 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.54 ' CE2' ' HG3' ' A' ' 42' ' ' ARG . 26.9 t80 -51.84 -38.56 56.39 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.512 -0.742 . . . . 0.0 109.046 179.475 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.478 ' O ' ' N ' ' A' ' 39' ' ' GLN . 44.8 t80 -56.35 -45.56 80.38 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 178.705 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.04 -39.4 93.29 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.066 -1.021 . . . . 0.0 109.899 179.319 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.449 HD12 ' O ' ' A' ' 33' ' ' LEU . 5.8 mp -44.88 -59.12 2.71 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.562 -0.711 . . . . 0.0 110.128 -179.466 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.461 ' CB ' HG21 ' A' ' 40' ' ' VAL . 87.9 m-70 -104.14 4.64 34.34 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.45 -0.781 . . . . 0.0 109.415 178.828 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 49.7 33.83 6.62 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.565 -0.709 . . . . 0.0 110.027 -178.702 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.461 HG21 ' CB ' ' A' ' 38' ' ' HIS . 11.1 m -140.17 163.79 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 O-C-N 121.463 -0.773 . . . . 0.0 110.018 -179.612 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -82.17 140.97 33.44 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.335 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.54 ' HG3' ' CE2' ' A' ' 34' ' ' TYR . 2.3 mmm180 -127.99 150.39 73.5 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.014 -1.054 . . . . 0.0 110.09 -179.493 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -57.09 151.68 49.07 Favored 'Trans proline' 0 C--N 1.315 -1.211 0 C-N-CA 123.005 2.47 . . . . 0.0 111.814 -179.074 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.427 ' HB2' ' HD3' ' A' ' 47' ' ' ARG . 1.0 OUTLIER -71.57 10.18 0.7 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.594 -0.691 . . . . 0.0 111.568 179.793 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.02 -32.41 61.82 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.611 -1.305 . . . . 0.0 110.18 179.54 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.07 -12.78 49.24 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.399 -0.813 . . . . 0.0 110.346 179.515 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.427 ' HD3' ' HB2' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -58.71 162.11 4.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.903 -1.123 . . . . 0.0 109.965 179.822 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.28 149.76 46.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.458 -0.776 . . . . 0.0 109.456 178.895 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -63.81 -35.01 79.21 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.493 -0.754 . . . . 0.0 110.175 -179.862 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . 0.472 ' HA2' HG21 ' A' ' 14' ' ' THR . . . -134.53 157.0 22.73 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 179.318 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.465 HD13 HG22 ' A' ' 51' ' ' ILE . 4.9 mt -53.31 119.5 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.157 -1.202 . . . . 0.0 109.987 -179.618 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.505 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -75.6 167.28 22.19 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.634 -0.666 . . . . 0.0 109.206 179.755 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.461 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -154.98 160.67 41.27 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.571 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.47 -161.66 1.39 Allowed 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -179.617 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.37 94.46 0.06 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.825 -1.172 . . . . 0.0 108.924 179.302 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.4 ' HD3' ' OP1' ' C' ' 126' ' ' ' DC' . 5.1 ptp180 -54.49 143.84 22.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.483 -0.761 . . . . 0.0 109.97 -179.502 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -61.65 123.33 17.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.358 -0.839 . . . . 0.0 109.152 179.797 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 61.9 t -53.14 153.15 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.386 -0.821 . . . . 0.0 110.539 -179.231 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.3 m -64.88 169.31 5.31 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 121.396 0.617 . . . . 0.0 110.324 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.495 1.783 0 O-C-N 121.264 -0.897 . . . . 0.0 109.858 179.761 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.528 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.688 0 O4'-C1'-N19 110.57 3.462 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.55 ' N7 ' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.441 1.582 1 O4'-C1'-N19 111.535 4.668 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.543 ' N6 ' ' N6 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.467 1 O4'-C1'-N19 111.424 4.529 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.533 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.544 1 O4'-C1'-N19 111.157 4.197 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.533 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.613 1.996 0 O4'-C1'-N19 110.697 3.621 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.087 0 O4'-C1'-N19 110.926 3.908 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.443 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.614 1 O4'-C1'-N19 111.454 4.568 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.443 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.704 0 O4'-C1'-N19 110.7 3.625 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.665 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.777 1 O4'-C1'-N19 111.166 4.208 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.665 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.527 1 O4'-C1'-N19 111.839 5.048 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.437 " H4'" ' HE3' ' A' ' 46' ' ' MET . . . . . . . . 0 C5'--C4' 1.527 2.035 1 O4'-C1'-N19 111.019 4.024 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.469 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.942 0 O4'-C1'-N19 110.544 3.429 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.543 ' N6 ' ' N6 ' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.295 0 O4'-C1'-N19 110.449 3.311 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.596 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.463 1 O4'-C1'-N19 112.453 5.816 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.489 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.611 0 O4'-C1'-N19 110.874 3.842 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.458 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.53 2.334 0 O4'-C1'-N19 110.923 3.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.814 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 . . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -81.26 -43.37 19.29 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.215 -0.928 . . . . 0.0 108.8 179.218 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.86 104.46 1.7 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.536 -0.728 . . . . 0.0 109.709 179.683 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.91 -18.23 12.68 Favored Glycine 0 N--CA 1.495 2.596 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.461 HG21 ' CH2' ' A' ' 18' ' ' TRP . 15.2 m -76.46 85.57 3.19 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.82 -1.4 . . . . 0.0 110.314 -179.789 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 m -85.77 120.37 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 178.18 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.484 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 51.5 t -45.46 111.55 0.35 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.206 -0.934 . . . . 0.0 110.202 -178.327 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 71.8 m -59.71 -14.31 13.64 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.171 -0.956 . . . . 0.0 111.437 -179.212 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.545 ' OD1' ' HD2' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -95.39 -30.83 13.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.634 -1.291 . . . . 0.0 110.734 -179.572 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.483 ' SG ' ' HD3' ' A' ' 47' ' ' ARG . 18.4 p -141.26 28.37 1.87 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.897 -1.127 . . . . 0.0 110.492 179.289 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.46 ' N ' ' O ' ' A' ' 7' ' ' CYS . 5.5 pm0 34.22 30.19 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.728 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 179.781 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.424 ' N ' ' O ' ' A' ' 10' ' ' CYS . 5.1 t -90.88 132.56 35.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.747 -1.22 . . . . 0.0 109.844 179.479 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.2 p -90.29 -28.6 18.67 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.237 -0.914 . . . . 0.0 109.107 179.379 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.7 p -89.86 111.04 21.95 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.431 -0.793 . . . . 0.0 109.479 179.5 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.487 HG21 ' CZ2' ' A' ' 18' ' ' TRP . 9.5 p -130.97 166.52 20.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.332 -0.855 . . . . 0.0 110.205 -179.712 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.596 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 16.2 p -89.41 -40.57 12.63 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.353 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.55 ' CD1' ' N7 ' ' B' ' 107' ' ' ' DG' . 14.3 mt -141.89 112.56 7.22 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.321 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.487 ' CZ2' HG21 ' A' ' 15' ' ' THR . 7.0 m95 -69.67 88.72 0.53 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.304 -0.873 . . . . 0.0 109.608 -179.389 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.78 84.85 7.2 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.61 -0.682 . . . . 0.0 109.424 -179.913 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.452 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 9.3 tpp180 -62.17 120.83 11.67 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.113 -0.992 . . . . 0.0 109.213 179.726 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.59 144.01 68.84 Favored Pre-proline 0 N--CA 1.498 1.932 0 O-C-N 121.298 -0.876 . . . . 0.0 110.187 -179.439 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -56.45 -42.49 65.09 Favored 'Trans proline' 0 C--N 1.319 -1.014 0 C-N-CA 122.737 2.291 . . . . 0.0 111.197 -179.294 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -21.03 39.62 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.299 -0.875 . . . . 0.0 110.061 179.486 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.63 35.92 1.65 Allowed Glycine 0 N--CA 1.497 2.759 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -127.03 102.75 24.13 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.207 -1.172 . . . . 0.0 110.142 -179.796 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.463 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.6 Cg_endo -64.02 98.56 0.26 Allowed 'Trans proline' 0 C--N 1.312 -1.364 0 C-N-CA 122.162 1.908 . . . . 0.0 109.604 178.793 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.484 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.0 m -109.74 153.94 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 CA-C-O 122.348 1.07 . . . . 0.0 111.114 -179.622 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.443 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 15.3 p -81.48 138.72 35.47 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.433 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.505 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 4.7 t-20 -37.96 -37.24 0.24 Allowed 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.695 -0.628 . . . . 0.0 111.971 -178.799 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . 0.423 ' HB3' ' OP2' ' C' ' 124' ' ' ' DA' . . . -64.39 -42.77 95.94 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.09 -1.006 . . . . 0.0 111.695 -179.329 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 4.9 m -61.52 -40.67 95.47 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.212 -0.93 . . . . 0.0 109.088 -179.934 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.4 -49.02 54.53 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.432 ' O ' HD12 ' A' ' 37' ' ' LEU . 94.8 mt -60.58 -58.41 8.6 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.638 -0.919 . . . . 0.0 109.63 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.592 ' CE1' ' HD2' ' A' ' 43' ' ' PRO . 20.4 t80 -54.51 -43.84 72.21 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.543 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.507 ' CD2' ' O ' ' A' ' 40' ' ' VAL . 20.0 t80 -51.91 -46.57 64.66 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.508 -0.745 . . . . 0.0 109.073 179.27 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -63.34 -41.92 98.9 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.214 -0.929 . . . . 0.0 110.152 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.432 HD12 ' O ' ' A' ' 33' ' ' LEU . 3.9 mp -45.36 -59.28 2.76 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.329 -0.857 . . . . 0.0 110.427 -179.439 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.407 ' HB2' ' CG2' ' A' ' 40' ' ' VAL . 53.4 m-70 -102.61 6.42 39.71 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.374 -0.829 . . . . 0.0 109.853 179.565 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.448 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.6 OUTLIER 46.7 31.89 1.55 Allowed 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.51 -0.744 . . . . 0.0 110.299 -179.212 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.507 ' O ' ' CD2' ' A' ' 35' ' ' TYR . 3.9 m -134.61 -161.47 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 O-C-N 121.476 -0.765 . . . . 0.0 109.048 179.652 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -59.1 -175.01 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.996 -1.065 . . . . 0.0 110.596 -179.883 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.545 ' HD2' ' OD1' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -141.1 102.91 6.17 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.106 -0.996 . . . . 0.0 109.969 -179.189 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.592 ' HD2' ' CE1' ' A' ' 34' ' ' TYR . 3.9 Cg_exo -60.62 126.05 18.87 Favored 'Trans proline' 0 C--N 1.315 -1.186 0 C-N-CA 121.991 1.794 . . . . 0.0 110.08 179.753 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 1.3 pp -85.05 16.43 3.47 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.385 -0.822 . . . . 0.0 110.935 -179.836 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 p -68.45 -5.65 20.46 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.02 -1.05 . . . . 0.0 111.07 -179.917 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' MET . . . . . 0.437 ' HE3' " H4'" ' C' ' 122' ' ' ' DT' . 65.9 mtp -94.23 -26.79 16.49 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.883 -1.136 . . . . 0.0 110.144 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.483 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -65.25 154.4 38.25 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.215 -0.928 . . . . 0.0 110.264 179.994 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.36 -158.61 0.9 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.921 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.08 -39.1 84.9 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.288 -0.882 . . . . 0.0 109.693 179.384 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.07 -175.33 14.13 Favored Glycine 0 N--CA 1.5 2.931 0 N-CA-C 110.19 -1.164 . . . . 0.0 110.19 179.513 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 3.8 mt -62.31 137.12 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.286 -1.126 . . . . 0.0 108.965 179.453 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.66 79.87 0.07 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.22 -0.925 . . . . 0.0 111.047 -178.638 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.06 159.54 15.43 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.137 -0.977 . . . . 0.0 110.4 179.564 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.64 -159.11 0.99 Allowed 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -52.56 103.15 0.06 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.833 -1.167 . . . . 0.0 109.159 179.208 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.5 ttm180 -50.74 140.8 14.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.369 -0.832 . . . . 0.0 110.339 -178.834 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.39 130.18 39.16 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.475 -0.766 . . . . 0.0 109.281 179.077 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -60.41 151.25 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.453 -0.78 . . . . 0.0 110.077 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.6 141.82 15.53 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.475 -0.765 . . . . 0.0 110.011 179.796 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.968 0 O-C-N 121.378 -0.826 . . . . 0.0 110.655 -179.515 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.544 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.72 0 O4'-C1'-N19 110.557 3.447 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.544 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.081 1 O4'-C1'-N19 111.932 5.165 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.598 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.959 0 O4'-C1'-N19 110.867 3.834 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.598 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.726 1 O4'-C1'-N19 111.266 4.333 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.534 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.922 0 O4'-C1'-N19 110.797 3.746 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.965 0 O4'-C1'-N19 110.787 3.734 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.442 1.723 1 O4'-C1'-N19 111.094 4.117 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.832 0 O4'-C1'-N19 110.449 3.311 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.577 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.725 0 O4'-C1'-N19 110.838 3.798 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.577 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.456 1 O4'-C1'-N19 111.784 4.98 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.503 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.412 0 O4'-C1'-N19 110.997 3.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.513 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.067 0 O4'-C1'-N19 110.655 3.569 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.513 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.325 0 O4'-C1'-N19 110.519 3.399 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.553 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.526 1.894 1 O4'-C1'-N19 112.383 5.728 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.525 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.763 0 O4'-C1'-N19 110.553 3.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.479 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.808 0 O4'-C1'-N19 110.922 3.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt . . . . . 0 N--CA 1.5 2.048 0 CA-C-O 120.822 0.344 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -78.19 -3.38 42.31 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.974 -1.079 . . . . 0.0 110.767 -179.82 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.84 109.7 2.58 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.146 -0.971 . . . . 0.0 109.384 179.315 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.25 -26.52 5.51 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.399 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.452 HG21 ' CB ' ' A' ' 26' ' ' PRO . 70.8 m -68.4 92.64 0.44 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.302 -1.117 . . . . 0.0 109.089 179.295 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -90.91 138.26 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.283 -0.886 . . . . 0.0 108.722 179.839 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.652 ' HB2' HG22 ' A' ' 12' ' ' THR . 24.6 t -62.42 118.08 7.02 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.146 -0.971 . . . . 0.0 110.973 -179.35 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 m -60.4 -15.47 26.52 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.387 -0.821 . . . . 0.0 110.295 178.85 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 9.0 m120 -102.82 -30.4 10.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.065 -1.022 . . . . 0.0 110.852 -179.764 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.489 ' SG ' ' HG3' ' A' ' 47' ' ' ARG . 12.8 p -142.66 23.43 1.94 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.672 -1.268 . . . . 0.0 111.909 -179.306 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 38.25 37.5 0.16 Allowed 'General case' 0 N--CA 1.511 2.597 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 178.483 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.652 HG22 ' HB2' ' A' ' 7' ' ' CYS . 5.3 t -88.14 135.13 33.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.527 -1.358 . . . . 0.0 108.694 178.333 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.4 p -90.44 -10.79 42.45 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.159 -0.963 . . . . 0.0 109.736 179.922 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 34.7 p -121.26 132.53 54.86 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.217 -0.927 . . . . 0.0 108.697 178.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.58 HG23 HG21 ' A' ' 12' ' ' THR . 6.5 p -145.74 157.18 43.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.411 -0.806 . . . . 0.0 109.668 -179.811 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.553 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 18.4 p -77.93 -35.63 50.24 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.281 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.491 HD23 ' N7 ' ' B' ' 106' ' ' ' DA' . 12.6 mt -146.53 106.58 4.0 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.599 -0.688 . . . . 0.0 109.486 179.638 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -65.3 111.69 3.13 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.555 -0.715 . . . . 0.0 110.497 -179.372 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.29 72.07 5.3 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.242 -0.911 . . . . 0.0 109.126 179.276 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.509 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.9 OUTLIER -61.98 110.49 1.58 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.204 -0.935 . . . . 0.0 109.277 -179.965 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -75.2 154.2 86.3 Favored Pre-proline 0 N--CA 1.497 1.905 0 O-C-N 121.298 -0.876 . . . . 0.0 110.036 -179.705 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -53.39 -48.14 23.57 Favored 'Trans proline' 0 C--N 1.319 -1.017 0 C-N-CA 122.762 2.308 . . . . 0.0 111.407 -178.943 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.0 -21.58 59.21 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.341 -0.849 . . . . 0.0 110.05 179.503 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.44 50.59 0.65 Allowed Glycine 0 N--CA 1.496 2.689 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 -179.81 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -127.46 89.58 50.91 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.574 -0.956 . . . . 0.0 109.994 -179.377 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.509 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 1.4 Cg_endo -66.4 94.51 0.31 Allowed 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 122.299 1.999 . . . . 0.0 110.0 179.434 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.484 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -109.69 125.86 66.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.06 -1.025 . . . . 0.0 110.52 -179.833 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.548 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 5.2 p -49.98 134.26 21.69 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.674 -0.641 . . . . 0.0 110.07 179.786 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.475 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 1.7 t-20 -36.77 -47.74 0.69 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.876 -0.515 . . . . 0.0 111.519 -178.952 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.39 -46.2 25.86 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.43 -0.794 . . . . 0.0 110.578 -179.66 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 27.0 m -66.34 -43.8 85.08 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.21 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.51 -32.17 68.27 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 110.114 -1.194 . . . . 0.0 110.114 179.069 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 61.0 mt -79.53 -62.29 1.74 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.334 -1.098 . . . . 0.0 109.844 179.905 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -50.99 -36.73 40.72 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.292 -0.88 . . . . 0.0 108.79 179.346 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.512 ' O ' ' N ' ' A' ' 39' ' ' GLN . 31.0 t80 -61.88 -46.49 89.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.45 -0.781 . . . . 0.0 109.712 179.298 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -22.03 57.96 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.259 -1.525 . . . . 0.0 110.079 179.457 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.475 HD12 ' N ' ' A' ' 37' ' ' LEU . 8.1 mp -74.54 -71.82 0.32 Allowed 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.976 -1.078 . . . . 0.0 109.851 179.836 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 51.7 m-70 -93.95 -18.81 21.53 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.309 -0.869 . . . . 0.0 110.477 -179.901 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.512 ' N ' ' O ' ' A' ' 35' ' ' TYR . 2.3 tt0 61.54 53.36 3.36 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-O 122.192 0.996 . . . . 0.0 109.951 -179.897 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.6 m -138.51 168.08 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.185 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.7 p-10 -70.24 126.15 28.83 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.813 -1.179 . . . . 0.0 109.337 179.917 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.414 ' CD ' ' HD2' ' A' ' 43' ' ' PRO . 5.4 tpt180 -96.62 110.53 53.53 Favored Pre-proline 0 N--CA 1.493 1.706 0 O-C-N 121.205 -0.934 . . . . 0.0 109.735 -179.444 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.414 ' HD2' ' CD ' ' A' ' 42' ' ' ARG . 6.2 Cg_exo -56.15 147.21 66.63 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 C-N-CA 121.976 1.784 . . . . 0.0 110.408 179.272 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.6 OUTLIER -71.27 7.73 1.22 Allowed 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.429 -0.794 . . . . 0.0 111.615 -179.795 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -50.25 -30.68 12.26 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.905 -1.122 . . . . 0.0 109.933 179.232 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.0 ttp -103.56 -24.13 13.44 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.342 -0.849 . . . . 0.0 110.227 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.489 ' HG3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -59.22 143.52 48.81 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.152 -0.967 . . . . 0.0 109.92 -179.858 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.439 ' HB2' ' OE1' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -123.39 157.21 33.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.261 -0.899 . . . . 0.0 109.709 179.587 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -71.37 -29.71 65.28 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.599 -0.688 . . . . 0.0 110.323 -179.596 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -111.71 132.6 10.95 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 179.548 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.9 mt -51.04 125.11 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.724 -0.868 . . . . 0.0 110.63 -179.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.439 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -73.72 157.17 37.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.609 -0.682 . . . . 0.0 109.61 179.24 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.06 164.15 38.25 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.01 -1.056 . . . . 0.0 109.825 179.201 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.92 -158.79 0.95 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.587 -0.696 . . . . 0.0 109.383 -179.677 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -55.83 98.47 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.899 -1.126 . . . . 0.0 108.961 179.215 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -49.99 139.74 13.38 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.499 -0.751 . . . . 0.0 110.818 -178.602 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.22 126.23 30.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.584 -0.698 . . . . 0.0 109.432 179.455 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 34.4 m -71.51 -167.17 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.361 -0.837 . . . . 0.0 109.575 179.577 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' SER . . . . . 0.411 ' CB ' ' OP1' ' C' ' 127' ' ' ' DT' . 85.5 p -88.35 147.25 24.85 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.052 -1.03 . . . . 0.0 110.292 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 30.8 t . . . . . 0 N--CA 1.496 1.838 0 O-C-N 121.152 -0.967 . . . . 0.0 109.276 179.771 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.451 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.987 0 O4'-C1'-N19 110.855 3.819 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.451 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.394 1 O4'-C1'-N19 111.25 4.313 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.588 ' H61' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.533 2.702 1 O4'-C1'-N19 111.006 4.007 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.54 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.661 0 O4'-C1'-N19 110.948 3.935 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.54 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.191 0 O4'-C1'-N19 110.925 3.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.419 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.877 0 O4'-C1'-N19 110.881 3.852 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.419 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.442 1.718 1 O4'-C1'-N19 111.356 4.445 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.036 0 O4'-C1'-N19 110.603 3.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.655 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.614 1 O4'-C1'-N19 111.59 4.738 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.655 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.427 1 O4'-C1'-N19 111.932 5.165 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.466 ' C4 ' ' N3 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.795 1 O4'-C1'-N19 112.35 5.688 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.506 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.142 0 O4'-C1'-N19 110.868 3.834 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.514 " C5'" ' HG2' ' A' ' 52' ' ' GLN . . . . . . . . 0 C5'--C4' 1.535 3.061 1 O4'-C1'-N19 111.259 4.323 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.51 H2'' ' C6 ' ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.285 1 O4'-C1'-N19 112.338 5.672 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.51 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.535 2.967 0 O4'-C1'-N19 110.572 3.465 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.486 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.443 0 O4'-C1'-N19 110.845 3.806 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.099 0 N-CA-C 110.156 -0.312 . . . . 0.0 110.156 . . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.06 12.23 5.31 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.976 -1.077 . . . . 0.0 110.211 179.159 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.95 115.56 4.51 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.934 -1.103 . . . . 0.0 108.865 179.359 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.95 -11.23 6.96 Favored Glycine 0 N--CA 1.497 2.726 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 -179.192 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.458 HG21 ' CD2' ' A' ' 18' ' ' TRP . 93.9 m -65.45 88.53 0.09 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.071 -1.253 . . . . 0.0 109.626 179.702 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.9 m -88.53 112.08 23.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 179.16 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.563 ' CB ' HG21 ' A' ' 12' ' ' THR . 52.7 t -46.88 113.36 0.65 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.277 -0.889 . . . . 0.0 110.071 -178.486 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.1 m -61.17 -14.81 27.82 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.359 -0.838 . . . . 0.0 111.073 -179.484 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.427 ' CB ' ' SG ' ' A' ' 31' ' ' CYS . 12.1 m-20 -94.76 -30.09 14.43 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.863 -1.148 . . . . 0.0 110.988 -179.485 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.579 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 18.5 p -139.66 19.84 2.52 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.56 -1.338 . . . . 0.0 111.383 179.598 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 7' ' ' CYS . 3.9 mt-30 45.81 26.17 0.35 Allowed 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.233 -0.917 . . . . 0.0 111.97 179.014 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.563 HG21 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -84.94 136.7 33.51 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.709 -1.244 . . . . 0.0 109.977 179.684 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 p -93.48 1.54 56.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.565 -0.71 . . . . 0.0 109.427 178.89 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.449 ' HB ' HG13 ' A' ' 51' ' ' ILE . 79.2 p -127.42 130.9 50.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.047 -1.033 . . . . 0.0 110.111 -179.606 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.526 HG22 ' CZ3' ' A' ' 18' ' ' TRP . 9.3 p -147.89 143.03 27.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.443 -0.786 . . . . 0.0 109.771 179.625 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.506 HG21 ' OP2' ' C' ' 125' ' ' ' DT' . 44.6 p -72.12 -33.57 67.91 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 178.791 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.588 ' CD1' ' H61' ' B' ' 108' ' ' ' DA' . 69.3 mt -142.39 105.54 4.59 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.067 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.526 ' CZ3' HG22 ' A' ' 15' ' ' THR . 12.5 m95 -64.77 86.34 0.05 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.418 -0.802 . . . . 0.0 109.656 -179.877 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.33 81.39 0.37 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 109.73 -179.795 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.481 ' HD3' ' CA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.96 101.45 0.21 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.073 -1.017 . . . . 0.0 108.766 179.517 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.93 141.72 47.45 Favored Pre-proline 0 N--CA 1.497 1.894 0 O-C-N 121.411 -0.806 . . . . 0.0 109.997 -179.034 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -53.88 -36.21 82.44 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 122.504 2.136 . . . . 0.0 110.962 -179.318 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' MET . . . . . 0.442 ' HA ' ' CE ' ' A' ' 23' ' ' MET . 1.1 tpt -60.03 -22.21 62.35 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.365 -0.834 . . . . 0.0 109.871 179.318 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.92 33.25 2.05 Favored Glycine 0 N--CA 1.497 2.722 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.659 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -126.09 113.0 24.07 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.172 -1.193 . . . . 0.0 110.42 -179.557 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.481 ' CA ' ' HD3' ' A' ' 20' ' ' ARG . 3.2 Cg_exo -64.1 100.1 0.3 Allowed 'Trans proline' 0 C--N 1.316 -1.174 0 C-N-CA 122.313 2.009 . . . . 0.0 110.083 178.879 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.501 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -119.88 127.17 75.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.126 -0.984 . . . . 0.0 110.149 179.947 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.478 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 8.3 p -51.43 136.54 25.44 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.479 -0.763 . . . . 0.0 109.397 179.331 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -43.36 -43.42 5.08 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.418 -0.801 . . . . 0.0 111.611 -178.252 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.34 -44.38 34.27 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.255 -0.903 . . . . 0.0 110.287 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.427 ' SG ' ' CB ' ' A' ' 9' ' ' ASN . 5.4 m -63.69 -43.67 95.94 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.342 -0.849 . . . . 0.0 109.229 179.235 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.4 -57.18 15.97 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 110.35 -1.1 . . . . 0.0 110.35 -179.859 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.488 ' O ' HD13 ' A' ' 37' ' ' LEU . 16.9 mt -60.77 -55.79 28.97 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.452 -1.028 . . . . 0.0 109.357 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.45 ' OH ' ' HG3' ' A' ' 42' ' ' ARG . 75.0 t80 -49.95 -43.88 50.23 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.613 -0.68 . . . . 0.0 109.597 179.498 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -56.17 -45.93 79.53 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.301 -0.874 . . . . 0.0 109.285 179.388 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.36 -30.94 71.54 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.095 -1.003 . . . . 0.0 110.142 179.435 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.488 HD13 ' O ' ' A' ' 33' ' ' LEU . 4.7 mp -61.73 -65.62 0.66 Allowed 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.098 -1.001 . . . . 0.0 110.625 -179.608 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.423 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 59.8 m-70 -95.59 9.32 40.61 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.221 -0.924 . . . . 0.0 110.532 -179.66 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.423 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER 41.08 32.51 0.18 Allowed 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.519 -0.738 . . . . 0.0 111.424 -179.182 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 4.5 m -145.57 169.77 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 121.281 -0.887 . . . . 0.0 109.807 179.759 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -85.85 154.23 21.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.262 -0.898 . . . . 0.0 109.368 178.899 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.45 ' HG3' ' OH ' ' A' ' 34' ' ' TYR . 30.0 mmt180 -149.98 151.18 31.69 Favored Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 121.061 -1.024 . . . . 0.0 109.77 179.519 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -59.33 147.51 90.7 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 C-N-CA 122.205 1.936 . . . . 0.0 110.785 179.961 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.579 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -89.73 37.64 0.88 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.123 -0.986 . . . . 0.0 110.806 -179.781 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.0 p -70.59 -11.28 60.84 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.011 -1.055 . . . . 0.0 109.971 178.894 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 1.4 tmm? -88.1 -18.55 28.6 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.236 -0.915 . . . . 0.0 110.445 179.64 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.489 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -57.24 139.01 53.98 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.89 -1.131 . . . . 0.0 110.036 -179.889 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -99.49 -177.57 3.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.387 -0.821 . . . . 0.0 109.493 -179.981 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -64.04 -37.5 87.66 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.253 -0.904 . . . . 0.0 110.032 -179.811 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -142.8 171.21 24.92 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.637 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.449 HG13 ' HB ' ' A' ' 14' ' ' THR . 14.5 mt -54.44 121.87 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.381 -1.07 . . . . 0.0 109.861 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.514 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -68.35 146.83 52.9 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.39 -0.819 . . . . 0.0 108.822 179.182 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.38 157.59 41.5 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.297 -0.877 . . . . 0.0 109.763 179.278 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.413 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -152.44 -168.71 3.13 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 -179.904 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -61.8 105.5 0.56 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.885 -1.134 . . . . 0.0 108.279 179.012 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.485 ' HD3' ' OP1' ' C' ' 126' ' ' ' DC' . 2.8 ptp180 -45.25 135.37 5.86 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.286 -0.884 . . . . 0.0 110.048 -178.583 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.99 142.8 11.34 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.511 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.1 p -47.34 134.08 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.504 -0.747 . . . . 0.0 109.565 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.71 125.85 14.24 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.645 -0.659 . . . . 0.0 110.065 -179.329 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.499 1.988 0 O-C-N 121.366 -0.834 . . . . 0.0 110.236 179.842 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.525 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.782 0 O4'-C1'-N19 110.341 3.176 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.547 ' O6 ' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.066 1 O4'-C1'-N19 112.579 5.974 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.536 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.534 2.86 1 O4'-C1'-N19 111.202 4.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.551 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.15 1 O4'-C1'-N19 111.244 4.305 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.551 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.612 1.863 0 O4'-C1'-N19 110.834 3.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.937 0 O4'-C1'-N19 110.67 3.588 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.452 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.77 1 O4'-C1'-N19 111.225 4.282 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.452 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.91 0 O4'-C1'-N19 110.468 3.335 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.574 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 P--O5' 1.61 1.749 0 O4'-C1'-N19 110.777 3.722 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.574 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.402 1 O4'-C1'-N19 111.717 4.896 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.359 1 O4'-C1'-N19 111.042 4.052 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.49 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 P--O5' 1.612 1.918 0 O4'-C1'-N19 110.704 3.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.493 H2'' " O5'" ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.31 0 O4'-C1'-N19 110.539 3.424 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.525 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.532 2.563 1 O4'-C1'-N19 112.122 5.402 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.466 ' OP1' ' HD2' ' A' ' 56' ' ' ARG . . . . . . . . 0 C5'--C4' 1.532 2.627 0 O4'-C1'-N19 110.66 3.575 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.422 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.533 2.795 1 O4'-C1'-N19 111.007 4.009 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.1 mttt . . . . . 0 N--CA 1.494 1.744 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . 0.501 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 6.4 ttt180 -86.72 88.3 7.64 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.407 -0.808 . . . . 0.0 109.67 -179.793 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -68.81 133.24 48.04 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.394 -0.816 . . . . 0.0 109.359 179.809 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 109.03 -30.34 8.77 Favored Glycine 0 N--CA 1.498 2.825 0 N-CA-C 109.531 -1.427 . . . . 0.0 109.531 -179.348 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.543 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 16.2 m -78.62 90.24 4.55 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.128 -1.219 . . . . 0.0 109.579 179.654 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.9 m -81.93 116.13 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 179.175 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.485 ' CB ' HG23 ' A' ' 12' ' ' THR . 41.3 t -49.1 113.87 0.89 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.203 -0.935 . . . . 0.0 110.11 -178.61 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -60.11 -15.29 22.23 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.635 -0.666 . . . . 0.0 111.141 -179.497 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 5.8 m-20 -96.69 -30.64 13.11 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.911 -1.118 . . . . 0.0 111.376 -179.051 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.516 ' HB2' ' HA ' ' A' ' 44' ' ' LEU . 15.6 p -140.49 26.16 2.16 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.698 -1.251 . . . . 0.0 111.189 179.939 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 40.56 27.88 0.04 OUTLIER 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.161 -0.962 . . . . 0.0 112.627 178.422 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.485 HG23 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -89.59 136.78 32.83 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.569 -1.332 . . . . 0.0 110.081 179.925 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.0 p -92.22 -30.42 15.92 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.493 -0.754 . . . . 0.0 109.033 179.168 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.5 p -92.45 125.32 37.05 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.364 -0.835 . . . . 0.0 109.601 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.573 HG23 ' CZ3' ' A' ' 18' ' ' TRP . 16.4 p -143.3 148.94 37.12 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.165 -0.96 . . . . 0.0 110.814 179.961 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.525 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 70.6 p -73.87 -33.92 64.25 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.956 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.547 ' CD1' ' O6 ' ' B' ' 107' ' ' ' DG' . 15.6 mt -150.87 105.45 3.27 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.405 -0.81 . . . . 0.0 108.92 179.536 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.573 ' CZ3' HG23 ' A' ' 15' ' ' THR . 7.0 m95 -63.49 84.22 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.421 -0.799 . . . . 0.0 110.936 -178.856 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -80.43 77.51 7.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.08 -1.012 . . . . 0.0 109.194 179.36 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.576 ' CB ' ' HA ' ' A' ' 26' ' ' PRO . 5.2 ppt_? -80.0 138.62 37.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.022 -1.049 . . . . 0.0 110.033 -179.56 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -86.89 148.27 45.2 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.255 -0.903 . . . . 0.0 109.944 -179.802 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -55.0 -31.3 73.85 Favored 'Trans proline' 0 C--N 1.319 -1.026 0 C-N-CA 122.522 2.148 . . . . 0.0 111.024 -179.7 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.04 -28.56 53.12 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.409 -0.807 . . . . 0.0 109.803 179.195 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 117.09 34.52 1.22 Allowed Glycine 0 N--CA 1.497 2.713 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 179.678 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -130.88 96.03 24.02 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.281 -1.129 . . . . 0.0 109.911 -179.794 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.576 ' HA ' ' CB ' ' A' ' 20' ' ' ARG . 2.3 Cg_endo -65.17 106.21 0.79 Allowed 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 122.465 2.11 . . . . 0.0 110.31 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.456 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -119.1 129.27 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.071 -1.018 . . . . 0.0 110.428 -179.985 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.451 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 6.6 p -52.33 133.57 34.55 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 121.387 -0.82 . . . . 0.0 109.42 179.468 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.404 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 18.9 t-20 -34.34 -49.73 0.39 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.724 -0.61 . . . . 0.0 112.203 -178.445 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -46.82 -49.05 20.65 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.383 -0.823 . . . . 0.0 110.767 -179.424 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.473 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 27.1 m -62.56 -45.46 92.83 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.383 -0.823 . . . . 0.0 109.096 179.533 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.21 -30.59 64.4 Favored Glycine 0 N--CA 1.494 2.553 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 179.832 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 60.6 mt -80.34 -63.12 1.48 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.391 -1.064 . . . . 0.0 109.8 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -52.59 -35.17 53.67 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.32 -0.862 . . . . 0.0 109.174 179.635 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.578 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 8.5 t80 -66.37 -52.81 42.99 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.515 -0.74 . . . . 0.0 110.232 179.493 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -54.84 -28.42 49.68 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.135 -1.603 . . . . 0.0 109.985 -179.992 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mp -72.67 -64.37 0.97 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.083 -1.011 . . . . 0.0 110.662 -179.988 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.439 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 15.1 m-70 -96.87 -28.01 14.42 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.141 -0.974 . . . . 0.0 110.653 -179.198 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.578 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.2 OUTLIER 76.08 26.53 0.98 Allowed 'General case' 0 N--CA 1.503 2.191 0 CA-C-O 121.599 0.714 . . . . 0.0 111.039 -179.929 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.0 m -113.91 166.93 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.035 -1.041 . . . . 0.0 109.848 178.63 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.8 p-10 -84.82 130.48 34.66 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.149 -0.969 . . . . 0.0 110.097 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -105.98 137.38 19.35 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.381 -0.825 . . . . 0.0 109.96 -179.554 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -63.57 145.53 91.85 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 122.237 1.958 . . . . 0.0 110.224 179.204 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.516 ' HA ' ' HB2' ' A' ' 10' ' ' CYS . 1.7 pp -72.54 -4.23 29.35 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.206 -0.933 . . . . 0.0 110.943 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.64 -26.59 22.92 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.068 -1.02 . . . . 0.0 110.261 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -65.94 -26.37 67.56 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.899 -1.125 . . . . 0.0 109.685 179.17 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.02 165.68 24.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.182 -0.949 . . . . 0.0 109.687 179.475 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -127.96 -166.18 1.58 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.182 -0.949 . . . . 0.0 109.332 -179.938 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -46.83 -64.73 0.7 Allowed 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.315 -0.866 . . . . 0.0 109.958 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -117.74 -177.13 17.33 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.344 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.3 mt -54.43 128.65 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.144 -1.21 . . . . 0.0 109.912 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.61 144.21 51.25 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.448 -0.782 . . . . 0.0 110.088 -179.933 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.16 160.92 41.28 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.373 -0.83 . . . . 0.0 109.549 178.959 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.67 -158.27 0.89 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.62 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -58.16 114.97 2.63 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.908 -1.12 . . . . 0.0 108.499 179.233 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.466 ' HD2' ' OP1' ' C' ' 126' ' ' ' DC' . 4.1 ttp180 -47.17 141.02 4.71 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.567 -0.708 . . . . 0.0 111.007 -178.622 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.48 127.94 32.04 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.585 -0.697 . . . . 0.0 109.74 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.65 158.23 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.644 -0.66 . . . . 0.0 109.476 179.935 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.8 p -64.1 135.34 56.29 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.065 -1.022 . . . . 0.0 109.312 179.909 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.6 t . . . . . 0 N--CA 1.495 1.81 0 O-C-N 121.281 -0.887 . . . . 0.0 109.006 -179.558 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.623 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.613 1.999 0 O4'-C1'-N19 110.817 3.771 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.623 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.029 1 O4'-C1'-N19 111.441 4.552 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.62 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.307 0 O4'-C1'-N19 110.957 3.946 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.62 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.005 0 O4'-C1'-N19 110.817 3.771 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.552 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.915 0 O4'-C1'-N19 110.67 3.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.41 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.909 0 O4'-C1'-N19 110.899 3.873 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.402 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.801 1 O4'-C1'-N19 111.65 4.813 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.787 0 O4'-C1'-N19 110.542 3.427 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.711 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.737 1 O4'-C1'-N19 111.457 4.571 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.711 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.533 2.715 1 O4'-C1'-N19 111.959 5.199 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.342 1 O4'-C1'-N19 111.243 4.304 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.427 ' OP2' ' HB2' ' A' ' 34' ' ' TYR . . . . . . . . 0 C5'--C4' 1.528 2.141 0 O4'-C1'-N19 110.496 3.37 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.546 " H3'" ' CG2' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.534 2.852 0 O4'-C1'-N19 110.654 3.568 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.674 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.419 1 O4'-C1'-N19 112.266 5.583 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.483 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.535 2.971 0 O4'-C1'-N19 110.909 3.886 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.442 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.533 2.783 0 O4'-C1'-N19 110.9 3.875 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.816 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 . . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -26.3 31.58 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.325 -0.86 . . . . 0.0 109.344 179.964 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.37 107.6 2.47 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.072 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.2 -12.49 7.16 Favored Glycine 0 N--CA 1.495 2.604 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 -179.333 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.507 HG21 ' CB ' ' A' ' 26' ' ' PRO . 17.4 m -54.4 100.58 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.025 -1.279 . . . . 0.0 108.942 179.188 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 9.7 m -87.03 137.37 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 120.987 -1.071 . . . . 0.0 108.981 -179.454 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.541 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 31.9 t -67.02 117.57 9.26 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.335 -0.853 . . . . 0.0 110.583 -179.257 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.8 m -63.05 -7.61 5.8 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.381 -0.824 . . . . 0.0 110.545 178.913 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.452 ' ND2' HG11 ' A' ' 27' ' ' VAL . 1.2 m-80 -109.82 -28.14 8.94 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.93 -1.106 . . . . 0.0 111.177 -179.389 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.512 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 14.6 p -142.5 17.22 2.03 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 120.501 -1.375 . . . . 0.0 111.59 -179.813 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 47.64 26.3 0.82 Allowed 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.21 -0.931 . . . . 0.0 112.116 178.576 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.437 HG23 ' HB2' ' A' ' 7' ' ' CYS . 3.3 t -90.11 128.7 36.38 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.582 -1.324 . . . . 0.0 109.521 179.147 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.48 -27.99 19.97 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.849 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -88.8 106.59 18.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.483 -0.761 . . . . 0.0 109.562 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.524 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 17.8 p -128.34 157.05 42.05 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.449 -0.782 . . . . 0.0 110.212 -179.69 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.674 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 40.8 p -86.31 -39.68 16.25 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.946 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.585 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 23.3 mt -138.04 102.27 4.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.435 -0.79 . . . . 0.0 109.417 179.638 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.524 ' CZ2' HG23 ' A' ' 15' ' ' THR . 5.7 m95 -62.9 106.76 0.86 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.39 -0.819 . . . . 0.0 110.148 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -97.42 73.87 2.44 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.445 -0.785 . . . . 0.0 109.384 179.828 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.475 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -67.04 112.37 4.35 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.224 -0.922 . . . . 0.0 109.124 179.898 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.04 150.99 97.41 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.178 -0.951 . . . . 0.0 109.434 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -52.81 -41.06 72.69 Favored 'Trans proline' 0 C--N 1.317 -1.091 0 C-N-CA 122.486 2.124 . . . . 0.0 111.186 -179.147 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -25.29 50.22 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.264 -0.897 . . . . 0.0 110.06 179.331 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.5 44.43 0.84 Allowed Glycine 0 N--CA 1.497 2.746 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 179.767 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -128.08 98.74 26.3 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.326 -1.103 . . . . 0.0 110.46 -179.652 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.517 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.0 Cg_endo -66.5 94.91 0.32 Allowed 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.372 2.048 . . . . 0.0 109.998 178.811 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.541 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -114.08 123.71 70.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 120.961 -1.087 . . . . 0.0 110.406 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.6 p -48.42 132.8 16.67 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.64 -0.663 . . . . 0.0 109.379 179.338 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.585 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t-20 -40.44 -40.98 1.31 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.658 -0.652 . . . . 0.0 111.568 -177.943 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.58 -43.98 56.7 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.96 -1.088 . . . . 0.0 110.478 179.773 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.402 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 13.3 m -65.73 -39.2 90.89 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.314 -0.866 . . . . 0.0 109.265 179.445 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.14 -53.98 12.69 Favored Glycine 0 N--CA 1.496 2.697 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.634 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 48.0 mt -57.32 -57.2 13.66 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.341 -1.094 . . . . 0.0 109.941 -179.462 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.553 ' OH ' ' HD2' ' A' ' 42' ' ' ARG . 78.5 t80 -50.67 -43.97 57.61 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.583 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.617 ' O ' ' N ' ' A' ' 39' ' ' GLN . 27.4 t80 -57.57 -54.79 42.82 Favored 'General case' 0 C--O 1.195 -1.811 0 O-C-N 121.502 -0.749 . . . . 0.0 109.402 179.456 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -49.42 -34.35 16.24 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 119.932 -1.73 . . . . 0.0 111.096 179.781 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.404 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 9.6 mp -57.94 -65.12 0.69 Allowed 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.082 -1.011 . . . . 0.0 110.408 -179.638 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 -99.11 -33.15 10.9 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.256 -0.903 . . . . 0.0 109.03 179.549 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.617 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 73.2 47.99 0.18 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.868 0.842 . . . . 0.0 110.099 179.088 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 m -140.57 166.26 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 178.544 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -77.61 145.52 36.73 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.854 -1.154 . . . . 0.0 109.396 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.553 ' HD2' ' OH ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -146.22 150.23 40.77 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 120.918 -1.114 . . . . 0.0 110.125 -179.686 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.445 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 5.9 Cg_exo -57.18 147.43 76.09 Favored 'Trans proline' 0 C--N 1.314 -1.243 0 C-N-CA 122.227 1.952 . . . . 0.0 110.796 -179.947 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.512 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.4 OUTLIER -86.59 23.93 1.54 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.498 -0.751 . . . . 0.0 110.591 179.993 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 70.5 p -68.67 -12.69 61.69 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.999 -1.063 . . . . 0.0 110.336 179.374 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -86.11 -31.27 21.97 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.252 -0.905 . . . . 0.0 110.303 -179.83 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.486 ' HG2' ' N ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -80.62 158.49 25.67 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.11 -0.994 . . . . 0.0 109.775 -179.814 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.486 ' N ' ' HG2' ' A' ' 47' ' ' ARG . 10.3 tttp -131.78 173.56 11.04 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.054 -1.029 . . . . 0.0 109.93 179.78 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.48 -37.72 77.38 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.354 -0.841 . . . . 0.0 109.586 179.854 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -97.63 132.32 10.93 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 179.158 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.438 ' CG2' ' CG2' ' A' ' 16' ' ' THR . 4.8 mt -53.47 104.04 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.387 -1.066 . . . . 0.0 109.912 -179.626 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . 0.459 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 1.9 mt-30 -46.5 96.76 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.009 0 O-C-N 122.047 -0.408 . . . . 0.0 111.041 -179.363 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -121.86 153.04 38.91 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.949 -1.094 . . . . 0.0 110.859 179.583 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.542 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 1.6 ptm180 -154.17 -154.45 0.52 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 115.541 -0.754 . . . . 0.0 108.971 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . 0.481 ' N ' ' HG3' ' A' ' 54' ' ' ARG . 23.7 t-20 -58.54 121.09 10.1 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 177.988 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . 0.454 ' CB ' " H4'" ' C' ' 125' ' ' ' DT' . 0.0 OUTLIER -86.14 -169.43 2.64 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.419 -0.8 . . . . 0.0 111.083 -178.449 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -84.19 157.04 21.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.305 -0.872 . . . . 0.0 109.645 179.904 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 14.6 p -79.99 166.43 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.837 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 12.4 p -54.44 113.48 1.29 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.905 -1.122 . . . . 0.0 109.124 179.588 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.495 1.823 0 O-C-N 121.451 -0.781 . . . . 0.0 110.731 -178.91 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.547 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.957 0 O4'-C1'-N19 110.708 3.635 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.562 ' N7 ' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.526 1.814 1 O4'-C1'-N19 111.874 5.092 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.555 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.076 1 O4'-C1'-N19 111.043 4.054 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.555 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.105 1 O4'-C1'-N19 111.05 4.063 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.544 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.868 0 O4'-C1'-N19 110.524 3.405 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.158 0 O4'-C1'-N19 110.68 3.601 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.444 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.04 1 O4'-C1'-N19 111.202 4.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . 0.444 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.612 1.901 0 C3'-C2'-C1' 107.177 3.198 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.654 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.813 1 O4'-C1'-N19 111.113 4.141 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.654 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.533 2.781 1 O4'-C1'-N19 111.877 5.097 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.413 ' C7 ' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.468 1 O4'-C1'-N19 111.01 4.012 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.455 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.237 0 O4'-C1'-N19 110.633 3.541 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.455 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.728 0 O4'-C1'-N19 110.62 3.525 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.617 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.71 1 O4'-C1'-N19 112.435 5.794 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.481 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.098 0 O4'-C1'-N19 110.578 3.473 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.439 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.174 0 O4'-C1'-N19 110.749 3.686 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.5 mttt . . . . . 0 N--CA 1.498 1.948 0 CA-C-O 120.919 0.39 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -81.6 74.65 8.58 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.15 -0.969 . . . . 0.0 110.008 -179.576 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.23 113.79 3.08 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.473 -0.767 . . . . 0.0 109.294 179.608 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.9 -30.26 4.89 Favored Glycine 0 N--CA 1.496 2.682 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 -179.202 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' THR . . . . . 0.458 HG23 ' HB2' ' A' ' 26' ' ' PRO . 4.9 m -72.18 88.93 1.15 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.266 -1.138 . . . . 0.0 109.472 179.505 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 15.9 m -78.73 120.19 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.124 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.508 ' HB2' HG22 ' A' ' 12' ' ' THR . 45.3 t -49.42 112.78 0.69 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.191 -0.943 . . . . 0.0 110.585 -178.411 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 71.0 m -57.19 -16.97 9.29 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.412 -0.805 . . . . 0.0 110.839 179.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . 0.472 ' CB ' ' SG ' ' A' ' 31' ' ' CYS . 25.3 m-20 -98.87 -31.01 12.07 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.002 -1.061 . . . . 0.0 111.437 -179.206 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.484 ' SG ' ' HD3' ' A' ' 47' ' ' ARG . 19.1 p -138.73 22.02 2.68 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.468 -1.395 . . . . 0.0 111.474 179.294 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.479 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER 44.59 21.02 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.303 -0.873 . . . . 0.0 112.692 178.851 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.508 HG22 ' HB2' ' A' ' 7' ' ' CYS . 6.1 t -80.78 130.48 35.09 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.579 -1.325 . . . . 0.0 109.749 179.927 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.0 p -90.47 -4.93 56.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.29 -0.881 . . . . 0.0 109.42 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 31.9 p -118.65 121.45 40.18 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -0.947 . . . . 0.0 110.085 -179.616 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.524 HG22 ' CZ2' ' A' ' 18' ' ' TRP . 21.5 p -143.58 160.88 39.85 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.323 -0.861 . . . . 0.0 110.117 179.475 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.617 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 21.3 p -81.52 -47.45 13.1 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.877 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.562 ' CD1' ' N7 ' ' B' ' 107' ' ' ' DG' . 10.9 mt -130.94 109.92 10.89 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.686 -0.633 . . . . 0.0 109.37 179.206 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.524 ' CZ2' HG22 ' A' ' 15' ' ' THR . 16.7 m95 -79.34 85.83 5.13 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.577 -0.702 . . . . 0.0 109.79 -179.615 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . 0.545 ' HD3' ' HA ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -77.57 93.64 4.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.073 -1.017 . . . . 0.0 109.335 179.556 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.471 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -68.06 124.21 22.77 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.33 -0.856 . . . . 0.0 110.149 -179.27 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -81.26 141.17 49.46 Favored Pre-proline 0 N--CA 1.499 1.989 0 O-C-N 121.361 -0.837 . . . . 0.0 109.559 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -54.36 -41.17 78.91 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 122.515 2.144 . . . . 0.0 110.933 -179.766 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.3 mtp -59.78 -20.44 56.74 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.32 -0.863 . . . . 0.0 109.95 179.386 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.54 39.66 1.44 Allowed Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 179.827 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -127.6 91.19 46.3 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.379 -1.071 . . . . 0.0 110.146 -179.818 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.471 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 2.6 Cg_endo -64.36 100.3 0.32 Allowed 'Trans proline' 0 C--N 1.311 -1.424 0 C-N-CA 122.203 1.935 . . . . 0.0 109.524 179.064 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.465 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.0 m -109.12 153.88 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 120.869 -1.144 . . . . 0.0 110.998 -179.476 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.507 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 16.0 p -81.8 138.88 35.06 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.545 ' HA ' ' HD3' ' A' ' 19' ' ' ARG . 6.0 t-20 -38.12 -36.64 0.22 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.781 -0.575 . . . . 0.0 111.812 -178.64 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.69 -43.07 81.01 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.271 -0.893 . . . . 0.0 111.76 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.472 ' SG ' ' CB ' ' A' ' 9' ' ' ASN . 1.8 m -57.98 -41.01 82.07 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.001 -1.062 . . . . 0.0 109.621 -179.671 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . 0.456 ' HA3' ' CZ ' ' A' ' 19' ' ' ARG . . . -74.02 -39.59 45.46 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 -179.925 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 25.0 mt -64.65 -65.15 0.71 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.484 -1.01 . . . . 0.0 110.26 -179.616 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.597 ' CD1' ' HB3' ' A' ' 42' ' ' ARG . 23.3 t80 -51.74 -39.98 59.44 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.233 -0.917 . . . . 0.0 108.843 179.77 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.485 ' O ' ' N ' ' A' ' 39' ' ' GLN . 60.2 t80 -53.59 -47.81 69.81 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.564 -0.71 . . . . 0.0 109.633 179.198 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -66.99 -38.67 86.44 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.208 -0.933 . . . . 0.0 110.14 -179.902 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 0.4 OUTLIER -45.27 -53.21 8.67 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.293 -0.879 . . . . 0.0 110.031 -179.564 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.5 ' CB ' HG23 ' A' ' 40' ' ' VAL . 37.6 m-70 -111.53 6.37 20.07 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.351 -0.843 . . . . 0.0 109.549 179.156 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 35' ' ' TYR . 3.2 tp-100 49.22 32.67 4.42 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.431 -0.793 . . . . 0.0 110.133 -178.751 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.5 HG23 ' CB ' ' A' ' 38' ' ' HIS . 4.0 m -134.08 -174.44 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.503 -0.748 . . . . 0.0 109.558 179.826 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -61.97 172.5 1.35 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.237 -0.915 . . . . 0.0 110.319 179.574 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.597 ' HB3' ' CD1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -133.36 131.38 21.51 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.24 -0.912 . . . . 0.0 109.451 -179.867 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.24 112.93 1.85 Allowed 'Trans proline' 0 C--N 1.315 -1.218 0 C-N-CA 122.135 1.89 . . . . 0.0 110.335 179.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.486 ' O ' ' HG2' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -72.74 -7.24 49.61 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.21 -0.931 . . . . 0.0 110.378 179.779 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 75.0 p -54.42 -20.66 7.9 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.05 -1.031 . . . . 0.0 110.003 178.631 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.03 -15.36 62.55 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.139 -0.975 . . . . 0.0 110.725 179.627 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.486 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 12.0 mmm180 -56.56 148.03 20.69 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 120.719 -1.238 . . . . 0.0 110.24 -179.785 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.85 -162.92 1.27 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.42 -0.8 . . . . 0.0 109.852 -179.916 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -79.99 -41.17 26.4 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.12 -0.988 . . . . 0.0 109.884 179.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -133.15 165.89 23.88 Favored Glycine 0 N--CA 1.498 2.793 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 5.4 mt -56.59 125.87 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.195 -1.18 . . . . 0.0 109.973 179.87 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.63 154.53 32.58 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.561 -0.712 . . . . 0.0 109.589 179.247 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.84 165.32 36.83 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.977 -1.077 . . . . 0.0 109.252 179.1 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.42 ' NH1' ' CG ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -150.46 -172.68 4.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.539 -0.725 . . . . 0.0 109.382 -179.421 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -51.69 118.69 3.55 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.106 -0.996 . . . . 0.0 108.718 179.228 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -47.43 140.58 5.62 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.581 -0.7 . . . . 0.0 110.351 -178.985 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.2 ttmt -54.25 134.95 44.94 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.581 -0.699 . . . . 0.0 110.149 -179.742 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.38 137.27 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.495 -0.753 . . . . 0.0 109.415 179.69 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.77 115.04 15.05 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.256 -0.903 . . . . 0.0 109.778 -179.566 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.494 1.736 0 O-C-N 121.23 -0.919 . . . . 0.0 110.306 -179.873 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 106' ' ' ' DA' . . . . . 0.506 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.928 0 O4'-C1'-N19 110.702 3.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 107' ' ' ' DG' . . . . . 0.506 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.932 1 O4'-C1'-N19 111.469 4.586 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 108' ' ' ' DA' . . . . . 0.531 ' N6 ' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.349 1 O4'-C1'-N19 111.043 4.054 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 109' ' ' ' DT' . . . . . 0.537 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 P--O5' 1.615 2.211 0 O4'-C1'-N19 110.901 3.877 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 110' ' ' ' DA' . . . . . 0.537 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.208 0 O4'-C1'-N19 110.778 3.723 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 111' ' ' ' DA' . . . . . 0.402 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.97 0 O4'-C1'-N19 110.855 3.818 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 112' ' ' ' DA' . . . . . 0.402 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.955 1 O4'-C1'-N19 111.711 4.889 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.926 0 O4'-C1'-N19 110.558 3.447 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' C' C ' 120' ' ' ' DG' . . . . . 0.672 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.921 1 O4'-C1'-N19 111.152 4.19 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 121' ' ' ' DT' . . . . . 0.672 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.533 2.775 1 O4'-C1'-N19 111.864 5.08 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 122' ' ' ' DT' . . . . . 0.409 ' P ' HD23 ' A' ' 37' ' ' LEU . . . . . . . . 0 C5'--C4' 1.533 2.713 1 O4'-C1'-N19 111.434 4.543 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 123' ' ' ' DT' . . . . . 0.474 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.112 0 O4'-C1'-N19 110.912 3.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 124' ' ' ' DA' . . . . . 0.475 " H2'" ' H72' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.466 0 O4'-C1'-N19 110.816 3.769 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 125' ' ' ' DT' . . . . . 0.615 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.127 1 O4'-C1'-N19 111.965 5.206 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' C' C ' 126' ' ' ' DC' . . . . . 0.615 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.695 0 O4'-C1'-N19 110.407 3.258 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' C' C ' 127' ' ' ' DT' . . . . . 0.445 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.306 0 O4'-C1'-N19 110.646 3.557 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.854 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -83.65 2.33 38.06 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.312 -0.868 . . . . 0.0 110.4 179.718 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.4 119.52 7.12 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.251 -0.906 . . . . 0.0 109.039 179.209 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.3 -23.83 5.41 Favored Glycine 0 N--CA 1.496 2.649 0 N-CA-C 109.266 -1.534 . . . . 0.0 109.266 -178.947 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.0 m -69.13 93.36 0.59 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.31 -1.112 . . . . 0.0 109.843 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.68 129.74 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 178.41 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' CYS . . . . . 0.6 ' HB2' HG23 ' A' ' 12' ' ' THR . 6.9 t -45.13 111.98 0.39 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.523 -0.736 . . . . 0.0 111.132 -178.638 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -60.58 -13.32 13.53 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.25 -0.906 . . . . 0.0 110.671 179.679 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -105.03 -28.59 10.96 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.776 -1.203 . . . . 0.0 111.589 -179.309 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' CYS . . . . . 0.602 ' SG ' ' HD2' ' A' ' 47' ' ' ARG . 9.4 p -138.71 24.7 2.62 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.637 -1.289 . . . . 0.0 110.59 179.005 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' GLN . . . . . 0.513 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 1.3 pt20 38.45 25.98 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 179.132 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' THR . . . . . 0.6 HG23 ' HB2' ' A' ' 7' ' ' CYS . 3.8 t -90.1 124.18 34.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.589 -1.319 . . . . 0.0 109.816 179.228 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.07 -23.96 21.28 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.447 -0.783 . . . . 0.0 109.711 -179.867 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' THR . . . . . 0.477 ' HB ' HG13 ' A' ' 51' ' ' ILE . 2.9 p -89.86 94.13 9.7 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.225 -0.922 . . . . 0.0 109.173 179.807 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' THR . . . . . 0.467 HG22 ' CZ2' ' A' ' 18' ' ' TRP . 5.2 p -117.71 149.59 40.5 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.269 -0.895 . . . . 0.0 110.059 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' THR . . . . . 0.467 ' CG2' " H3'" ' C' ' 124' ' ' ' DA' . 30.7 p -74.04 -33.72 63.83 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 179.145 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' LEU . . . . . 0.531 ' CD1' ' N6 ' ' B' ' 108' ' ' ' DA' . 73.3 mt -146.32 108.52 4.42 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.34 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' TRP . . . . . 0.467 ' CZ2' HG22 ' A' ' 15' ' ' THR . 9.6 m95 -65.39 86.33 0.07 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.382 -0.824 . . . . 0.0 109.696 -179.774 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -76.98 80.25 3.52 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.433 -0.792 . . . . 0.0 109.381 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ARG . . . . . 0.455 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -57.91 123.45 15.84 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.364 -0.835 . . . . 0.0 109.594 -179.832 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 t -78.58 145.99 68.53 Favored Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.346 -0.846 . . . . 0.0 109.912 -179.599 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -58.76 -23.17 65.28 Favored 'Trans proline' 0 C--N 1.319 -1.024 0 C-N-CA 122.443 2.095 . . . . 0.0 110.482 179.185 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.04 1.28 21.47 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.207 -0.933 . . . . 0.0 110.307 179.309 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.85 29.89 16.72 Favored Glycine 0 N--CA 1.497 2.741 0 N-CA-C 109.412 -1.475 . . . . 0.0 109.412 -179.562 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -121.34 101.03 44.4 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.406 -1.055 . . . . 0.0 110.339 -179.419 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' PRO . . . . . 0.455 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 3.2 Cg_exo -63.11 99.69 0.23 Allowed 'Trans proline' 0 C--N 1.311 -1.417 0 C-N-CA 121.997 1.798 . . . . 0.0 109.605 178.48 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.513 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 1.6 m -110.34 154.56 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 CA-C-O 122.292 1.044 . . . . 0.0 111.024 -179.77 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.405 ' O ' ' C ' ' A' ' 29' ' ' ASN . 15.7 p -81.14 138.37 35.9 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.689 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' ASN . . . . . 0.421 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 3.5 t-20 -35.22 -46.8 0.37 Allowed 'General case' 0 N--CA 1.504 2.275 0 O-C-N 121.657 -0.652 . . . . 0.0 112.093 -178.551 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -55.15 -47.26 75.37 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.377 -0.827 . . . . 0.0 111.472 -179.339 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' CYS . . . . . 0.465 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 3.4 m -57.19 -38.66 73.98 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.091 -1.006 . . . . 0.0 109.81 179.966 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -72.92 -36.52 57.36 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.991 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' LEU . . . . . 0.417 ' HB3' ' C7 ' ' C' ' 123' ' ' ' DT' . 81.0 mt -73.15 -66.22 0.71 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.432 -1.04 . . . . 0.0 110.09 -179.851 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . 0.453 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 80.2 t80 -46.34 -34.46 4.58 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.357 -0.839 . . . . 0.0 109.173 179.655 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' TYR . . . . . 0.632 ' O ' ' N ' ' A' ' 39' ' ' GLN . 30.5 t80 -63.47 -62.58 1.58 Allowed 'General case' 0 C--O 1.193 -1.886 0 O-C-N 121.285 -0.885 . . . . 0.0 109.009 178.746 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 tttm -48.06 -30.41 4.41 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 120.084 -1.635 . . . . 0.0 110.799 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.453 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 9.6 mp -57.33 -69.52 0.16 Allowed 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.198 -0.939 . . . . 0.0 109.971 179.734 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' HIS . . . . . 0.454 ' HB2' HG21 ' A' ' 40' ' ' VAL . 17.6 m-70 -99.38 -28.74 13.14 Favored 'General case' 0 N--CA 1.506 2.34 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.039 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.632 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.9 OUTLIER 76.19 49.0 0.07 Allowed 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 122.059 0.933 . . . . 0.0 110.346 179.21 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' VAL . . . . . 0.454 HG21 ' HB2' ' A' ' 38' ' ' HIS . 2.8 m -133.44 -178.87 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.558 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -59.1 161.05 5.53 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.641 -1.287 . . . . 0.0 110.022 179.779 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' ARG . . . . . 0.499 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -127.21 106.69 21.69 Favored Pre-proline 0 N--CA 1.498 1.962 0 O-C-N 121.041 -1.037 . . . . 0.0 109.759 -179.12 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.16 141.93 90.08 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 122.353 2.035 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' LEU . . . . . 0.544 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -84.8 5.52 28.3 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.257 -0.902 . . . . 0.0 110.785 179.953 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 54.6 p -61.24 -26.7 67.93 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.461 -1.399 . . . . 0.0 109.696 179.054 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.65 4.19 33.57 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.133 -0.979 . . . . 0.0 110.821 179.79 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' ARG . . . . . 0.602 ' HD2' ' SG ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -82.35 -174.9 5.41 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.567 -1.333 . . . . 0.0 109.621 179.636 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -151.43 156.9 41.59 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.124 -0.985 . . . . 0.0 109.416 179.793 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -55.03 -35.2 64.19 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.295 -0.878 . . . . 0.0 109.792 179.878 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.88 146.92 16.63 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 109.071 -1.612 . . . . 0.0 109.071 179.033 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' ILE . . . . . 0.477 HG13 ' HB ' ' A' ' 14' ' ' THR . 6.0 mt -50.22 120.62 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.345 -1.091 . . . . 0.0 109.852 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.79 151.57 33.81 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.404 -0.81 . . . . 0.0 109.563 179.814 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' THR . . . . . 0.419 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -155.49 165.04 37.82 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.266 -0.896 . . . . 0.0 109.419 179.445 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' ARG . . . . . 0.475 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 2.1 mtm-85 -145.64 -152.49 0.43 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.625 -0.672 . . . . 0.0 109.709 -179.5 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.58 122.56 16.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.112 -0.993 . . . . 0.0 109.105 179.324 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.06 112.82 0.48 Allowed 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.446 0.641 . . . . 0.0 110.752 -179.171 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.19 112.21 7.15 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.389 -0.819 . . . . 0.0 109.287 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.9 p -80.09 149.1 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.192 -0.942 . . . . 0.0 108.917 179.604 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.68 139.45 57.22 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.083 -1.011 . . . . 0.0 109.732 -179.576 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.494 1.733 0 O-C-N 121.35 -0.844 . . . . 0.0 110.492 -179.739 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.946 0 CA-C-O 121.263 0.554 . . . . 0.0 109.619 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.32 -31.77 7.8 Favored Glycine 0 N--CA 1.494 2.549 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.603 HG23 ' HB2' ' A' ' 26' ' ' PRO . 3.5 m -63.5 91.69 0.06 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.343 -1.092 . . . . 0.0 109.137 178.984 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 m -88.93 122.17 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.516 ' CB ' HG22 ' A' ' 12' ' ' THR . 49.5 t -49.57 118.06 2.57 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.336 -0.853 . . . . 0.0 110.602 -178.662 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.1 m -65.33 -7.71 14.81 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.411 -0.806 . . . . 0.0 111.115 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.63 ' OD1' HG11 ' A' ' 27' ' ' VAL . 6.8 m120 -107.78 -23.64 12.0 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 120.732 -1.23 . . . . 0.0 110.858 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.534 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 14.0 p -145.41 20.63 1.53 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.669 -1.269 . . . . 0.0 111.176 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER 45.05 20.31 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.451 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 178.71 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.516 HG22 ' CB ' ' A' ' 7' ' ' CYS . 14.1 t -77.4 135.78 38.35 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.34 -1.475 . . . . 0.0 109.655 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.3 p -95.0 -21.37 18.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.536 -0.728 . . . . 0.0 109.347 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.505 ' HB ' HG13 ' A' ' 51' ' ' ILE . 72.3 p -109.45 120.31 42.1 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.249 -0.907 . . . . 0.0 109.772 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.584 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 4.4 p -135.71 159.77 40.62 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.279 -0.888 . . . . 0.0 109.591 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.437 HG22 HG21 ' A' ' 51' ' ' ILE . 6.0 p -83.54 -30.77 26.81 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.562 -0.711 . . . . 0.0 109.205 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.61 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 45.9 mt -142.13 91.3 2.33 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.345 -0.847 . . . . 0.0 109.371 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.568 ' CZ2' HG23 ' A' ' 15' ' ' THR . 18.5 m95 -64.2 109.1 1.75 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.296 -0.877 . . . . 0.0 109.806 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.566 ' HG3' ' O ' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -98.85 130.32 45.26 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.224 -0.922 . . . . 0.0 109.403 179.651 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.8 mmm180 -96.38 119.8 35.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.16 -0.963 . . . . 0.0 109.745 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.6 t -79.21 142.8 59.56 Favored Pre-proline 0 N--CA 1.499 2.018 0 O-C-N 121.206 -0.934 . . . . 0.0 109.478 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -54.32 -41.61 74.87 Favored 'Trans proline' 0 C--N 1.32 -0.959 0 C-N-CA 122.655 2.237 . . . . 0.0 111.0 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.7 mtm -62.05 -21.06 64.61 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.268 -0.895 . . . . 0.0 109.412 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.02 44.66 1.08 Allowed Glycine 0 N--CA 1.497 2.753 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -129.28 98.94 22.14 Favored Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.155 -1.203 . . . . 0.0 110.822 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.603 ' HB2' HG23 ' A' ' 5' ' ' THR . 1.8 Cg_endo -65.97 107.09 1.06 Allowed 'Trans proline' 0 C--N 1.314 -1.247 0 C-N-CA 122.101 1.867 . . . . 0.0 109.241 178.244 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.63 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.0 m -122.88 126.28 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 O-C-N 121.135 -0.978 . . . . 0.0 110.506 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.584 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.2 p -48.06 131.12 15.87 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.404 -0.81 . . . . 0.0 109.839 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.61 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 5.6 t-20 -35.09 -43.68 0.21 Allowed 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.837 -0.54 . . . . 0.0 112.156 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.43 -45.42 62.63 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.276 -0.89 . . . . 0.0 110.606 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.475 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 18.6 m -64.75 -37.44 87.59 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.331 -0.856 . . . . 0.0 108.999 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.29 -53.53 25.05 Favored Glycine 0 N--CA 1.495 2.602 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.529 ' O ' HD13 ' A' ' 37' ' ' LEU . 93.7 mt -55.74 -58.44 7.81 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.503 -0.998 . . . . 0.0 109.877 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.691 ' HA ' HD22 ' A' ' 37' ' ' LEU . 11.4 t80 -47.28 -42.62 21.24 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.489 -0.757 . . . . 0.0 109.749 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.417 ' O ' ' N ' ' A' ' 39' ' ' GLN . 40.4 t80 -52.29 -46.99 66.13 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.374 -0.829 . . . . 0.0 109.979 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.4 -38.1 77.8 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 120.82 -1.175 . . . . 0.0 110.206 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.691 HD22 ' HA ' ' A' ' 34' ' ' TYR . 6.0 mp -42.97 -52.46 5.19 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.565 -0.709 . . . . 0.0 110.16 -179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.465 ' CB ' HG22 ' A' ' 40' ' ' VAL . 78.6 m-70 -121.37 12.13 10.84 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.18 -0.95 . . . . 0.0 110.082 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.417 ' N ' ' O ' ' A' ' 35' ' ' TYR . 8.4 tt0 50.13 34.92 9.13 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.356 -0.84 . . . . 0.0 110.141 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.465 HG22 ' CB ' ' A' ' 38' ' ' HIS . 2.9 m -135.96 -165.42 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 O-C-N 121.313 -0.867 . . . . 0.0 109.203 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.7 p30 -62.93 -173.82 0.06 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.224 -0.922 . . . . 0.0 110.254 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.475 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -146.41 106.97 4.11 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.283 -0.885 . . . . 0.0 109.884 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.511 ' HD2' ' CZ ' ' A' ' 34' ' ' TYR . 3.5 Cg_exo -60.34 128.01 24.8 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 C-N-CA 122.234 1.956 . . . . 0.0 110.08 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.672 ' H ' HD23 ' A' ' 44' ' ' LEU . 0.9 OUTLIER -93.3 25.48 3.34 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.335 -0.853 . . . . 0.0 110.884 -179.299 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -6.91 29.67 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.031 -1.043 . . . . 0.0 110.849 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 57.8 mtm -102.93 -7.82 21.19 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.871 -1.143 . . . . 0.0 110.61 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.518 ' NH1' ' HG3' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -81.64 164.76 21.61 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.869 -1.144 . . . . 0.0 110.451 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.2 -169.12 3.23 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.365 -0.835 . . . . 0.0 109.719 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -78.84 -9.53 59.5 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.093 -1.004 . . . . 0.0 110.699 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -137.17 145.08 16.8 Favored Glycine 0 N--CA 1.499 2.882 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.505 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.1 mt -54.18 124.3 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.405 -1.056 . . . . 0.0 110.108 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.49 159.59 33.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.451 -0.781 . . . . 0.0 109.4 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.32 163.34 40.25 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.011 -1.055 . . . . 0.0 109.378 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -149.86 -163.26 1.74 Allowed 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.4 93.93 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.042 -1.036 . . . . 0.0 108.515 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.36 150.19 1.36 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.566 -0.709 . . . . 0.0 109.972 -179.317 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt . . . . . 0 N--CA 1.495 1.808 0 O-C-N 121.358 -0.839 . . . . 0.0 109.641 179.921 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.765 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.44 -30.44 3.45 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.369 -1.493 . . . . 0.0 109.369 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.471 HG22 ' CH2' ' A' ' 18' ' ' TRP . 72.8 m -72.09 86.15 1.04 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.088 -1.242 . . . . 0.0 109.316 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 6' ' ' VAL . 28.3 m -88.46 112.81 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.528 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 52.9 t -47.99 108.05 0.15 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.466 -0.771 . . . . 0.0 110.732 -178.43 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.9 m -59.76 -14.96 16.84 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.309 -0.869 . . . . 0.0 111.129 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.539 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 4.5 m-20 -90.36 -30.11 17.63 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.032 -1.043 . . . . 0.0 110.739 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.788 ' HA ' HD22 ' A' ' 44' ' ' LEU . 16.3 p -143.25 23.81 1.82 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.627 -1.296 . . . . 0.0 110.908 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.469 ' N ' ' O ' ' A' ' 7' ' ' CYS . 7.1 mt-30 44.61 22.56 0.06 Allowed 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.354 -0.842 . . . . 0.0 112.201 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.604 HG22 ' SG ' ' A' ' 10' ' ' CYS . 6.7 t -89.19 125.63 35.15 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.515 -1.366 . . . . 0.0 110.051 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.6 t -90.96 -17.11 26.91 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.638 -0.664 . . . . 0.0 109.639 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.529 ' HB ' HG13 ' A' ' 51' ' ' ILE . 23.0 p -101.42 115.63 30.93 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.252 -0.905 . . . . 0.0 109.035 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.529 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 6.9 p -135.44 153.17 51.86 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.218 -0.926 . . . . 0.0 110.211 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.636 HG22 HG21 ' A' ' 51' ' ' ILE . 40.7 p -83.43 -34.74 25.4 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.575 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 35.4 mt -137.61 96.96 3.34 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.475 -0.766 . . . . 0.0 109.312 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CZ3' HG21 ' A' ' 15' ' ' THR . 8.6 m95 -62.93 110.96 1.95 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.153 -0.967 . . . . 0.0 109.843 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.34 104.51 14.13 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.358 -0.839 . . . . 0.0 109.237 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.456 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -73.21 115.14 12.19 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.098 . . . . 0.0 108.812 179.784 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.537 ' HB3' ' HG2' ' A' ' 23' ' ' MET . 0.2 OUTLIER -67.95 144.49 97.2 Favored Pre-proline 0 N--CA 1.5 2.064 0 O-C-N 121.21 -0.931 . . . . 0.0 110.293 -179.118 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -55.18 -40.84 83.68 Favored 'Trans proline' 0 C--N 1.319 -1.013 0 C-N-CA 122.867 2.378 . . . . 0.0 110.952 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.537 ' HG2' ' HB3' ' A' ' 21' ' ' SER . 1.4 ptt? -54.73 -23.8 19.34 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.401 -0.812 . . . . 0.0 109.986 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.57 37.18 1.47 Allowed Glycine 0 N--CA 1.497 2.713 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -136.23 116.19 11.13 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 120.864 -1.374 . . . . 0.0 110.322 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 5.1 Cg_exo -62.06 106.13 0.44 Allowed 'Trans proline' 0 C--N 1.316 -1.177 0 C-N-CA 122.321 2.014 . . . . 0.0 110.026 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.528 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.8 m -120.37 126.01 74.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.104 -0.997 . . . . 0.0 110.665 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.408 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 9.7 p -49.27 133.67 19.13 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 121.443 0.64 . . . . 0.0 109.456 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.575 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 8.1 t-20 -37.9 -45.43 0.86 Allowed 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.578 -0.701 . . . . 0.0 111.577 -178.961 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.71 -46.49 40.77 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.208 -0.933 . . . . 0.0 110.96 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.539 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 6.9 m -60.24 -47.05 87.62 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.006 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.44 -32.44 64.38 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 109.626 -1.389 . . . . 0.0 109.626 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.537 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 81.9 mt -75.85 -64.01 1.18 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.512 -0.993 . . . . 0.0 109.284 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.487 ' HA ' HD22 ' A' ' 37' ' ' LEU . 9.3 t80 -47.13 -38.71 12.02 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.055 -1.028 . . . . 0.0 109.143 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.438 ' O ' ' N ' ' A' ' 39' ' ' GLN . 31.5 t80 -60.18 -49.54 77.23 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.48 -0.763 . . . . 0.0 109.787 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -62.06 -25.5 67.72 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.671 -1.268 . . . . 0.0 110.671 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.487 HD22 ' HA ' ' A' ' 34' ' ' TYR . 6.5 mp -62.19 -63.75 1.14 Allowed 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.206 -0.934 . . . . 0.0 110.268 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.529 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 69.8 m-70 -106.93 13.47 27.63 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.322 -0.862 . . . . 0.0 110.366 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 3.1 pm0 42.98 33.02 0.46 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.679 -0.638 . . . . 0.0 111.219 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 38' ' ' HIS . 5.4 m -136.01 164.72 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 O-C-N 121.15 -0.969 . . . . 0.0 110.176 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -84.45 136.31 33.9 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.438 -0.789 . . . . 0.0 108.974 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.4 ' HA ' ' HD3' ' A' ' 43' ' ' PRO . 2.5 mpt_? -131.78 148.07 68.5 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 121.273 -0.892 . . . . 0.0 109.994 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 42' ' ' ARG . 1.7 Cg_endo -63.02 144.33 92.67 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 122.44 2.093 . . . . 0.0 111.011 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.788 HD22 ' HA ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -84.49 41.63 0.85 Allowed 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.503 -0.748 . . . . 0.0 110.709 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.4 p -63.78 -17.32 62.95 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.136 -0.977 . . . . 0.0 110.373 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 32.6 ttp -97.45 -2.12 42.78 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.122 -0.986 . . . . 0.0 110.609 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.451 ' HB2' ' HB2' ' A' ' 44' ' ' LEU . 1.8 tpt180 -63.64 145.04 56.49 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 120.645 -1.285 . . . . 0.0 110.486 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.97 -176.27 2.86 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.405 -0.809 . . . . 0.0 109.943 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -78.45 -40.7 34.92 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.633 -0.667 . . . . 0.0 110.177 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.43 165.76 19.49 Favored Glycine 0 N--CA 1.5 2.937 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.636 HG21 HG22 ' A' ' 16' ' ' THR . 5.8 mt -58.13 123.78 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.52 -0.988 . . . . 0.0 110.217 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.86 159.29 31.12 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.556 -0.715 . . . . 0.0 109.856 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.98 162.91 40.28 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.272 -0.892 . . . . 0.0 109.275 179.079 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.415 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -150.59 -161.82 1.42 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.703 -0.623 . . . . 0.0 109.323 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.74 91.83 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.003 -1.061 . . . . 0.0 108.716 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.43 130.69 16.87 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.602 -0.686 . . . . 0.0 110.215 -178.989 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.865 0 O-C-N 121.504 -0.748 . . . . 0.0 110.008 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.714 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.84 -45.7 1.14 Allowed Glycine 0 N--CA 1.494 2.563 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.432 ' HB ' ' CZ2' ' A' ' 18' ' ' TRP . 3.9 m -65.43 102.51 0.7 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.118 -1.225 . . . . 0.0 109.503 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.9 m -104.01 113.22 40.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 43.7 t -51.1 107.31 0.17 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 109.536 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.6 m -57.79 -17.77 17.79 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.099 -1.0 . . . . 0.0 110.918 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.505 ' OD1' HG11 ' A' ' 27' ' ' VAL . 3.0 m120 -86.14 -30.88 22.17 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.102 -0.999 . . . . 0.0 111.016 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.5 p -142.72 23.02 1.95 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.571 -1.33 . . . . 0.0 111.437 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 7' ' ' CYS . 13.0 mm100 42.29 35.35 0.6 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.5 -0.75 . . . . 0.0 112.386 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.552 HG22 ' CB ' ' A' ' 7' ' ' CYS . 5.2 t -90.56 135.47 33.68 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.643 -1.286 . . . . 0.0 109.671 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.4 p -93.72 -18.46 22.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.537 -0.727 . . . . 0.0 109.749 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.524 ' HB ' HG13 ' A' ' 51' ' ' ILE . 69.3 p -111.58 126.11 54.65 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.023 -1.048 . . . . 0.0 109.329 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.405 ' O ' HD11 ' A' ' 51' ' ' ILE . 11.9 p -138.44 151.79 47.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.206 -0.934 . . . . 0.0 110.496 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.5 HG22 ' CG2' ' A' ' 51' ' ' ILE . 73.3 p -77.1 -32.75 56.82 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.633 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 52.4 mt -146.46 110.14 4.88 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 179.0 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.432 ' CZ2' ' HB ' ' A' ' 5' ' ' THR . 13.2 m95 -72.29 120.25 17.63 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.088 -1.008 . . . . 0.0 110.373 -179.194 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -106.51 82.17 1.69 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.491 -0.755 . . . . 0.0 109.45 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.466 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 6.7 tpp180 -60.95 118.45 6.73 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.418 -0.801 . . . . 0.0 109.377 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.481 ' HB3' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -82.63 143.53 47.41 Favored Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 121.326 -0.858 . . . . 0.0 109.785 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -55.97 -41.8 73.39 Favored 'Trans proline' 0 C--N 1.321 -0.89 0 C-N-CA 122.649 2.233 . . . . 0.0 111.103 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 mmt -56.39 -24.2 43.07 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.261 -0.899 . . . . 0.0 109.506 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.55 36.97 1.5 Allowed Glycine 0 N--CA 1.497 2.745 0 N-CA-C 109.914 -1.275 . . . . 0.0 109.914 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.481 ' O ' ' HB3' ' A' ' 21' ' ' SER . 15.2 m-20 -134.18 99.22 13.58 Favored Pre-proline 0 N--CA 1.495 1.775 0 O-C-N 121.192 -1.181 . . . . 0.0 110.388 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.558 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.8 Cg_endo -63.54 118.67 5.59 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 C-N-CA 122.039 1.826 . . . . 0.0 110.208 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.505 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.1 m -125.28 128.82 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 CA-C-O 121.868 0.842 . . . . 0.0 110.3 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.6 p -53.39 135.51 39.1 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.296 0.57 . . . . 0.0 109.73 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.633 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 22.9 t-20 -38.33 -47.2 1.19 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.627 -0.67 . . . . 0.0 112.035 -178.654 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.57 -46.13 27.74 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.223 -0.923 . . . . 0.0 110.858 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 22.6 m -65.48 -42.93 91.66 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.256 -0.903 . . . . 0.0 108.789 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.01 -50.37 66.13 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 110.459 -1.056 . . . . 0.0 110.459 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.559 HD23 ' CE ' ' A' ' 36' ' ' LYS . 68.1 mt -59.04 -66.72 0.46 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.369 -1.077 . . . . 0.0 109.608 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.524 ' CZ ' ' HG3' ' A' ' 42' ' ' ARG . 29.8 t80 -43.84 -38.46 3.32 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.558 -0.714 . . . . 0.0 109.687 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.548 ' O ' ' N ' ' A' ' 39' ' ' GLN . 15.9 t80 -62.02 -46.12 90.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.307 -0.87 . . . . 0.0 110.591 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.559 ' CE ' HD23 ' A' ' 33' ' ' LEU . 0.1 OUTLIER -60.37 -22.34 63.19 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.219 -1.551 . . . . 0.0 110.251 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.583 HD12 ' N ' ' A' ' 37' ' ' LEU . 7.2 mp -82.11 -55.54 4.5 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.021 -1.049 . . . . 0.0 110.027 -179.291 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.471 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 34.5 m-70 -97.44 -27.33 14.5 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.249 -0.907 . . . . 0.0 110.49 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 70.35 24.44 4.71 Favored 'General case' 0 N--CA 1.502 2.168 0 CA-C-O 121.591 0.71 . . . . 0.0 111.204 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.6 m -124.83 164.6 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 121.015 -1.053 . . . . 0.0 109.984 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -83.55 151.6 25.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.513 -0.742 . . . . 0.0 109.773 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.524 ' HG3' ' CZ ' ' A' ' 34' ' ' TYR . 13.2 mmt180 -133.84 147.65 65.11 Favored Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.387 -0.82 . . . . 0.0 110.002 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.479 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 1.0 OUTLIER -65.64 150.41 86.42 Favored 'Trans proline' 0 C--N 1.316 -1.145 0 C-N-CA 122.541 2.161 . . . . 0.0 110.656 179.671 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' ARG . 1.0 OUTLIER -68.6 0.92 3.57 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.192 -0.942 . . . . 0.0 110.876 179.462 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -35.08 45.46 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.936 -1.102 . . . . 0.0 110.257 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.59 -29.14 41.1 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.11 -0.994 . . . . 0.0 109.724 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.472 ' HB3' ' O ' ' A' ' 44' ' ' LEU . 0.5 OUTLIER -50.16 142.6 9.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.325 -0.859 . . . . 0.0 110.09 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.48 172.27 7.63 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.469 -0.769 . . . . 0.0 109.859 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -66.53 -66.25 0.58 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.337 -0.852 . . . . 0.0 109.853 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -117.0 164.4 12.41 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.524 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.0 mt -46.49 123.1 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.468 -1.019 . . . . 0.0 110.311 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -77.18 166.54 23.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.364 -0.835 . . . . 0.0 109.482 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.511 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.67 162.21 40.62 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.335 -0.853 . . . . 0.0 108.985 178.704 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -143.32 -162.06 1.38 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.54 -0.725 . . . . 0.0 109.661 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -62.42 117.14 5.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.98 -1.075 . . . . 0.0 109.089 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.53 134.63 19.27 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.541 -0.725 . . . . 0.0 110.898 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt . . . . . 0 N--CA 1.498 1.973 0 O-C-N 121.64 -0.662 . . . . 0.0 109.976 179.838 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.825 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.3 -15.05 7.75 Favored Glycine 0 N--CA 1.497 2.729 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.65 HG23 ' HB2' ' A' ' 26' ' ' PRO . 5.9 m -66.56 92.6 0.21 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.217 -1.167 . . . . 0.0 109.155 179.475 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 22.3 m -84.66 131.0 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.066 -1.021 . . . . 0.0 108.27 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.539 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 17.3 t -59.02 116.42 3.8 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.288 -0.882 . . . . 0.0 110.765 -178.722 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.1 m -62.01 -12.46 18.87 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.368 -0.832 . . . . 0.0 110.83 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.697 ' OD1' HG11 ' A' ' 27' ' ' VAL . 7.8 m120 -106.8 -25.31 11.76 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.946 -1.096 . . . . 0.0 111.516 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.616 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 10.8 p -142.69 18.39 2.0 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.65 -1.281 . . . . 0.0 111.255 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 46.83 21.34 0.14 Allowed 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.405 -0.809 . . . . 0.0 112.555 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.564 HG22 ' SG ' ' A' ' 10' ' ' CYS . 7.5 t -87.14 121.83 30.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.513 -1.367 . . . . 0.0 109.849 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.29 -26.67 21.02 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.498 ' HB ' HG13 ' A' ' 51' ' ' ILE . 6.3 p -89.14 96.22 10.63 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.427 -0.796 . . . . 0.0 108.958 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.53 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 5.3 p -118.02 166.41 12.57 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.014 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.508 HG22 HG21 ' A' ' 51' ' ' ILE . 69.4 p -96.02 -38.06 10.37 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.698 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 17.0 mt -137.4 90.56 2.52 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.305 -0.872 . . . . 0.0 108.662 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.53 ' CZ2' HG23 ' A' ' 15' ' ' THR . 10.8 m95 -54.12 113.59 1.3 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.118 -0.989 . . . . 0.0 110.433 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.483 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 3.0 tpp180 -99.75 86.18 3.26 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.276 -0.89 . . . . 0.0 109.014 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.408 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.4 mmm180 -71.2 90.93 0.92 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.281 -0.887 . . . . 0.0 109.019 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.3 t -55.24 142.65 57.98 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.456 -0.777 . . . . 0.0 110.254 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -56.68 -30.89 85.68 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 C-N-CA 122.682 2.254 . . . . 0.0 110.976 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.28 -22.99 62.02 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.314 -0.866 . . . . 0.0 109.534 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.35 40.74 1.6 Allowed Glycine 0 N--CA 1.496 2.685 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -136.18 105.05 9.47 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.246 -1.15 . . . . 0.0 110.347 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.65 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.3 Cg_endo -64.98 91.96 0.2 Allowed 'Trans proline' 0 C--N 1.314 -1.283 0 C-N-CA 122.337 2.025 . . . . 0.0 109.914 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.697 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.5 m -109.99 125.61 67.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.057 -1.027 . . . . 0.0 110.573 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.502 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.6 p -49.21 133.5 19.06 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.591 -0.693 . . . . 0.0 110.189 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.698 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 4.7 t-20 -39.92 -40.16 0.96 Allowed 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.577 -0.702 . . . . 0.0 111.586 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.54 -43.27 65.08 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.113 -0.992 . . . . 0.0 110.047 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 6.5 m -64.29 -41.52 96.83 Favored 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.55 -36.55 93.36 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 178.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 83.5 mt -73.3 -62.97 1.29 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.545 -0.974 . . . . 0.0 110.168 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.675 ' HA ' HD22 ' A' ' 37' ' ' LEU . 89.2 t80 -51.81 -34.43 40.16 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.128 -0.983 . . . . 0.0 109.141 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.469 ' O ' ' N ' ' A' ' 39' ' ' GLN . 36.0 t80 -58.0 -52.68 64.52 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.428 -0.795 . . . . 0.0 109.22 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 tttp -55.08 -31.33 61.1 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.074 -1.016 . . . . 0.0 110.433 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.675 HD22 ' HA ' ' A' ' 34' ' ' TYR . 2.2 mp -61.29 -68.11 0.34 Allowed 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.215 -0.928 . . . . 0.0 110.576 -179.147 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CB ' HG22 ' A' ' 40' ' ' VAL . 75.6 m-70 -96.9 10.0 40.32 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.053 -1.03 . . . . 0.0 110.412 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.491 ' HG3' ' O ' ' A' ' 38' ' ' HIS . 1.9 pt20 45.14 31.32 0.74 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.643 -0.661 . . . . 0.0 111.09 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.6 m -127.96 -170.01 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 121.351 -0.843 . . . . 0.0 109.582 179.522 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -60.62 178.63 0.21 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.274 -0.891 . . . . 0.0 110.558 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.461 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -131.52 106.43 14.42 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.073 -1.017 . . . . 0.0 109.915 -179.031 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -60.08 133.98 53.45 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 C-N-CA 122.387 2.058 . . . . 0.0 111.162 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.619 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -91.01 -1.6 57.79 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.288 -0.882 . . . . 0.0 110.928 -179.83 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 45' ' ' THR . 3.1 p -58.07 -16.68 13.84 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.067 -1.02 . . . . 0.0 110.903 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 18.0 ttp -94.84 -5.16 45.69 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.885 -1.134 . . . . 0.0 111.036 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.462 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -81.08 168.99 18.01 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 120.549 -1.344 . . . . 0.0 110.335 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -132.85 -174.83 3.58 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.226 -0.921 . . . . 0.0 109.735 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -77.09 -17.91 58.37 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.492 -0.755 . . . . 0.0 110.481 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.48 148.76 19.62 Favored Glycine 0 N--CA 1.5 2.944 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.508 HG21 HG22 ' A' ' 16' ' ' THR . 5.0 mt -53.33 110.44 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.311 -1.111 . . . . 0.0 110.091 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -47.03 123.19 5.04 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.831 -0.543 . . . . 0.0 109.955 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.58 156.44 42.43 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.005 -1.06 . . . . 0.0 110.51 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.38 -154.85 0.55 Allowed 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -62.98 87.05 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.045 -1.035 . . . . 0.0 108.615 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 ptt180 -50.81 156.55 0.94 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.397 -0.814 . . . . 0.0 110.715 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? . . . . . 0 N--CA 1.496 1.861 0 O-C-N 121.628 -0.67 . . . . 0.0 109.794 179.638 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.879 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.6 -35.48 4.98 Favored Glycine 0 N--CA 1.498 2.791 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.473 HG23 ' CB ' ' A' ' 26' ' ' PRO . 58.8 m -72.13 93.17 1.4 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.341 -1.093 . . . . 0.0 109.21 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.2 m -86.19 130.16 37.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.506 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 42.6 t -61.31 115.3 3.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.118 -0.988 . . . . 0.0 110.564 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.2 m -62.02 -12.73 20.27 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.416 -0.803 . . . . 0.0 110.864 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.449 ' ND2' HG11 ' A' ' 27' ' ' VAL . 57.2 m-20 -101.59 -30.14 11.55 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.068 -1.02 . . . . 0.0 110.989 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 14.5 p -141.51 26.06 1.98 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.625 -1.297 . . . . 0.0 111.336 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.632 ' HB2' HD22 ' A' ' 44' ' ' LEU . 12.4 mt-30 41.82 20.93 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.613 0 O-C-N 121.307 -0.871 . . . . 0.0 113.163 178.726 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.48 HG22 ' SG ' ' A' ' 10' ' ' CYS . 7.3 t -85.64 132.96 34.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.411 -1.431 . . . . 0.0 109.945 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.0 t -90.66 -30.41 17.16 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.534 -0.729 . . . . 0.0 109.313 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.5 p -89.98 131.38 35.9 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.332 -0.855 . . . . 0.0 108.861 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.493 ' C ' HD11 ' A' ' 51' ' ' ILE . 19.9 p -148.74 155.8 41.49 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.055 -1.028 . . . . 0.0 110.205 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 27.2 p -75.05 -44.86 45.28 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mt -144.84 114.05 7.0 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.415 ' CZ2' ' O ' ' A' ' 5' ' ' THR . 15.7 m95 -65.97 103.38 0.93 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.308 -0.87 . . . . 0.0 110.273 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.486 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 3.8 tpp180 -81.35 71.36 8.34 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.492 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.43 105.07 0.47 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.287 -0.883 . . . . 0.0 109.464 -179.595 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.419 ' OG ' ' HD2' ' A' ' 22' ' ' PRO . 0.3 OUTLIER -66.88 147.76 99.0 Favored Pre-proline 0 N--CA 1.501 2.113 0 O-C-N 121.295 -0.878 . . . . 0.0 110.193 -179.394 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.419 ' HD2' ' OG ' ' A' ' 21' ' ' SER . 6.2 Cg_exo -54.95 -38.06 93.14 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.586 2.191 . . . . 0.0 111.105 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -23.59 56.32 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.314 -0.867 . . . . 0.0 109.584 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.74 36.98 1.63 Allowed Glycine 0 N--CA 1.497 2.749 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -123.38 101.0 38.09 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.018 -1.283 . . . . 0.0 110.426 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 2.4 Cg_endo -65.05 91.4 0.2 Allowed 'Trans proline' 0 C--N 1.312 -1.364 0 C-N-CA 122.214 1.943 . . . . 0.0 110.096 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.506 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.6 m -109.24 127.48 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.249 -0.907 . . . . 0.0 110.04 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.44 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 9.2 p -51.55 134.1 29.68 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.666 -0.646 . . . . 0.0 109.622 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -39.88 -44.91 1.73 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.546 -0.722 . . . . 0.0 111.545 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.95 -44.17 50.46 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.475 -0.765 . . . . 0.0 110.48 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.6 m -61.59 -46.69 88.77 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.294 -0.879 . . . . 0.0 108.918 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -54.75 -38.59 64.63 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.2 mt -77.73 -60.56 2.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.422 -1.046 . . . . 0.0 109.739 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.643 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 32.9 t80 -49.52 -40.15 36.74 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.331 -0.856 . . . . 0.0 109.443 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.457 ' O ' ' N ' ' A' ' 39' ' ' GLN . 27.2 t80 -56.15 -49.37 74.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.511 -0.743 . . . . 0.0 109.44 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -32.27 69.09 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 120.869 -1.144 . . . . 0.0 110.049 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 34' ' ' TYR . 4.8 mp -60.37 -67.87 0.35 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.194 -0.941 . . . . 0.0 110.593 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.663 ' O ' HG22 ' A' ' 40' ' ' VAL . 56.3 m-70 -95.16 9.83 38.17 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.147 -0.97 . . . . 0.0 110.2 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 8.2 pt20 46.65 29.07 0.88 Allowed 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.655 -0.653 . . . . 0.0 111.29 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 38' ' ' HIS . 4.6 m -141.55 165.66 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 121.315 -0.866 . . . . 0.0 109.816 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.79 166.94 15.67 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.194 -0.941 . . . . 0.0 109.581 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.643 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 1.2 mmt180 -147.43 150.29 36.91 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.035 -1.041 . . . . 0.0 109.801 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.5 ' HD2' ' CD ' ' A' ' 42' ' ' ARG . 6.1 Cg_exo -56.54 150.25 52.97 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 C-N-CA 122.341 2.027 . . . . 0.0 110.584 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.632 HD22 ' HB2' ' A' ' 11' ' ' GLN . 1.2 pp -74.64 1.36 12.38 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.372 -0.83 . . . . 0.0 111.459 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.2 t -59.5 -14.76 14.01 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 120.817 -1.177 . . . . 0.0 110.766 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.3 ttt -72.81 -37.43 67.51 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.918 -1.114 . . . . 0.0 110.489 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.483 ' CZ ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -81.75 169.77 16.53 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.095 -1.003 . . . . 0.0 110.229 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -122.41 -169.9 1.98 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.125 -0.984 . . . . 0.0 110.229 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.72 -82.33 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.582 -0.699 . . . . 0.0 110.92 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -87.37 165.89 35.99 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.493 HD11 ' C ' ' A' ' 15' ' ' THR . 5.9 mt -54.3 136.63 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.003 -1.292 . . . . 0.0 110.109 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -66.36 138.09 57.35 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.677 -0.639 . . . . 0.0 109.825 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.85 163.63 38.97 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.093 -1.004 . . . . 0.0 109.593 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.87 -157.42 0.81 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.507 -0.745 . . . . 0.0 109.294 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -59.67 135.14 57.59 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.968 -1.082 . . . . 0.0 109.487 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.0 tpp180 -55.22 140.56 38.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.596 -0.69 . . . . 0.0 110.216 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.693 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.511 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 95.74 -30.14 8.83 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.348 -1.501 . . . . 0.0 109.348 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.514 HG23 ' CB ' ' A' ' 26' ' ' PRO . 11.2 m -58.31 93.46 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.231 -1.158 . . . . 0.0 109.063 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 4' ' ' GLY . 13.7 m -85.28 140.16 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.133 -0.979 . . . . 0.0 108.794 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.705 ' HB2' HG22 ' A' ' 12' ' ' THR . 31.4 t -64.67 120.36 12.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.161 -0.962 . . . . 0.0 110.252 -179.379 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 m -63.23 -14.03 44.63 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.392 -0.817 . . . . 0.0 110.427 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -107.64 -17.18 14.16 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.996 -1.065 . . . . 0.0 111.146 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.51 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 8.4 p -154.01 24.31 0.5 Allowed 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.565 -1.335 . . . . 0.0 111.116 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 7.7 pt20 33.73 34.41 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.605 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 178.718 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.705 HG22 ' HB2' ' A' ' 7' ' ' CYS . 6.1 t -83.79 131.33 34.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.541 -1.349 . . . . 0.0 109.165 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.3 p -89.28 -1.1 57.94 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.315 -0.865 . . . . 0.0 109.18 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.5 p -128.35 132.25 48.59 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.489 -0.757 . . . . 0.0 109.241 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.528 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 5.7 p -144.9 158.77 43.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.306 -0.871 . . . . 0.0 109.543 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.606 HG22 HG21 ' A' ' 51' ' ' ILE . 48.8 p -85.95 -26.99 25.21 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.663 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 59.9 mt -146.48 94.62 2.47 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.528 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.7 m95 -57.8 115.6 2.92 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.969 -1.082 . . . . 0.0 110.395 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.27 92.61 4.28 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.314 -0.866 . . . . 0.0 109.289 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.482 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -80.47 104.87 11.3 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.0 109.239 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.4 m -64.05 148.11 95.7 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.145 -0.972 . . . . 0.0 110.123 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -55.37 -44.92 44.13 Favored 'Trans proline' 0 C--N 1.319 -1.016 0 C-N-CA 122.771 2.314 . . . . 0.0 111.191 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 41.2 mtt -57.76 -21.54 41.96 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.236 -0.915 . . . . 0.0 110.153 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.444 ' HA2' ' NH1' ' A' ' 20' ' ' ARG . . . 111.04 45.36 0.88 Allowed Glycine 0 N--CA 1.497 2.716 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -128.34 92.68 40.54 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.572 -0.958 . . . . 0.0 110.172 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.514 ' CB ' HG23 ' A' ' 5' ' ' THR . 2.7 Cg_endo -63.47 95.63 0.18 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.08 1.854 . . . . 0.0 109.728 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.524 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.04 124.22 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.099 -1.0 . . . . 0.0 110.617 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.493 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.3 p -49.17 136.15 15.56 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.653 -0.654 . . . . 0.0 109.867 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.663 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 12.2 t-20 -40.2 -41.08 1.23 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.661 -0.65 . . . . 0.0 111.465 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.44 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -50.83 -45.81 59.74 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.372 -0.83 . . . . 0.0 110.265 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.454 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 34.6 m -67.92 -39.83 83.47 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.288 -0.882 . . . . 0.0 108.751 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.95 -39.21 95.28 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.163 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 65.0 mt -74.72 -60.74 2.14 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.415 -1.05 . . . . 0.0 109.881 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.568 ' CE1' ' HB3' ' A' ' 42' ' ' ARG . 47.3 t80 -49.22 -37.84 24.4 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.378 -0.826 . . . . 0.0 109.106 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.522 ' O ' ' N ' ' A' ' 39' ' ' GLN . 15.9 t80 -62.08 -52.88 62.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.543 -0.723 . . . . 0.0 109.659 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.42 -29.13 14.84 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.651 -1.28 . . . . 0.0 110.434 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.32 -63.39 1.07 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.027 -1.046 . . . . 0.0 110.862 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.454 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 8.6 m80 -97.42 -32.44 11.85 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.126 -0.984 . . . . 0.0 110.214 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 81.87 26.73 0.18 Allowed 'General case' 0 N--CA 1.504 2.265 0 CA-C-O 121.699 0.761 . . . . 0.0 110.689 -179.853 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.6 m -130.63 168.18 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 O-C-N 120.857 -1.152 . . . . 0.0 109.754 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -73.32 146.82 44.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.21 -0.931 . . . . 0.0 109.18 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.568 ' HB3' ' CE1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -128.5 149.94 73.12 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.069 -1.02 . . . . 0.0 110.456 -179.346 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.423 ' O ' ' HD3' ' A' ' 42' ' ' ARG . 2.1 Cg_endo -62.33 135.67 55.28 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 C-N-CA 122.506 2.137 . . . . 0.0 111.091 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.51 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -84.54 29.54 0.59 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.367 -0.833 . . . . 0.0 111.063 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.0 t -61.21 -17.4 53.03 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.751 -1.218 . . . . 0.0 110.473 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.51 -7.53 57.48 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.899 -1.126 . . . . 0.0 110.608 179.284 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.447 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -73.34 113.52 10.51 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.61 -1.307 . . . . 0.0 109.251 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.84 -156.25 0.57 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.474 -0.767 . . . . 0.0 110.172 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -73.91 0.12 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.472 -0.768 . . . . 0.0 110.328 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -102.84 174.04 23.11 Favored Glycine 0 N--CA 1.497 2.715 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.606 HG21 HG22 ' A' ' 16' ' ' THR . 6.1 mt -59.02 135.26 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.279 -1.13 . . . . 0.0 110.005 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -69.84 161.6 29.57 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.448 -0.782 . . . . 0.0 110.133 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.51 168.75 26.42 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.38 -0.825 . . . . 0.0 109.048 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.89 -169.37 3.36 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.259 -0.9 . . . . 0.0 109.203 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -56.17 100.13 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.947 -1.096 . . . . 0.0 108.704 179.144 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -46.43 127.15 8.88 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.572 -0.705 . . . . 0.0 110.7 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt . . . . . 0 N--CA 1.495 1.788 0 O-C-N 121.72 -0.612 . . . . 0.0 110.061 -179.97 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 121.287 0.565 . . . . 0.0 109.974 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.98 0.86 65.69 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.628 HG22 ' CH2' ' A' ' 18' ' ' TRP . 53.5 m -81.46 84.92 6.57 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.862 -1.375 . . . . 0.0 109.976 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 6' ' ' VAL . 21.9 m -85.23 114.69 25.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 178.658 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.652 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 1.7 t -42.61 113.22 0.44 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.45 -0.781 . . . . 0.0 110.932 -178.135 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' SER . . . . . 0.537 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 53.5 m -65.51 -12.58 54.09 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.134 -0.979 . . . . 0.0 111.276 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.826 ' HB2' HG12 ' A' ' 27' ' ' VAL . 4.4 m-20 -103.38 -24.84 13.46 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.955 -1.09 . . . . 0.0 110.583 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.518 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 9.2 p -144.7 25.83 1.44 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.88 -1.137 . . . . 0.0 110.767 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.812 ' HB2' HD22 ' A' ' 44' ' ' LEU . 0.0 OUTLIER 38.96 25.6 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.367 -0.833 . . . . 0.0 113.028 178.781 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' ' 7' ' ' CYS . 5.4 t -89.08 131.2 35.34 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.412 -1.43 . . . . 0.0 109.218 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.2 p -90.03 -29.82 18.15 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.493 ' HB ' ' CG1' ' A' ' 51' ' ' ILE . 2.9 p -93.79 124.8 38.03 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.419 -0.801 . . . . 0.0 109.438 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.601 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 11.9 p -134.01 140.15 46.51 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.35 -0.844 . . . . 0.0 109.244 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.517 HG22 HG21 ' A' ' 51' ' ' ILE . 70.4 p -62.14 -36.86 83.07 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 179.076 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.469 HD23 ' HA ' ' A' ' 17' ' ' LEU . 13.2 mt -149.56 112.28 4.79 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.587 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.628 ' CH2' HG22 ' A' ' 5' ' ' THR . 13.8 m95 -59.58 123.44 16.9 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.495 -0.753 . . . . 0.0 110.112 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.576 ' O ' HG23 ' A' ' 27' ' ' VAL . 2.0 ttm180 -116.34 74.47 0.9 Allowed 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.73 119.5 11.31 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.939 -1.101 . . . . 0.0 109.503 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.436 ' OG ' HG22 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -86.91 142.62 34.28 Favored Pre-proline 0 N--CA 1.501 2.085 0 O-C-N 121.016 -1.053 . . . . 0.0 110.006 -179.67 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -56.27 -28.67 72.7 Favored 'Trans proline' 0 C--N 1.32 -0.946 0 C-N-CA 122.722 2.281 . . . . 0.0 110.981 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.5 mtp -55.45 -25.11 34.62 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.469 -0.77 . . . . 0.0 109.63 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.14 35.31 2.55 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.657 -1.377 . . . . 0.0 109.657 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -137.8 108.38 8.4 Favored Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 121.381 -1.07 . . . . 0.0 109.966 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.537 ' HD2' ' OG ' ' A' ' 8' ' ' SER . 2.9 Cg_endo -60.7 99.7 0.15 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 C-N-CA 121.786 1.657 . . . . 0.0 110.087 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.826 HG12 ' HB2' ' A' ' 9' ' ' ASN . 2.1 m -109.97 147.51 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.173 -0.954 . . . . 0.0 109.745 179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.448 ' N ' ' SG ' ' A' ' 7' ' ' CYS . 30.4 p -83.5 153.65 24.3 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.286 -0.884 . . . . 0.0 108.656 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.513 ' OD1' HD12 ' A' ' 33' ' ' LEU . 11.2 t-20 -41.36 -42.56 2.27 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.562 -0.712 . . . . 0.0 110.079 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.67 -43.46 97.62 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.32 -0.863 . . . . 0.0 110.794 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 1.7 m -58.97 -44.21 91.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.099 -1.001 . . . . 0.0 108.924 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -68.82 -38.78 85.69 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 36.3 mt -69.5 -66.07 0.63 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.373 -1.075 . . . . 0.0 110.609 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HA ' HD13 ' A' ' 37' ' ' LEU . 80.2 t80 -49.91 -35.29 23.24 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.98 -1.075 . . . . 0.0 109.57 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.572 ' CE1' ' HG3' ' A' ' 39' ' ' GLN . 29.4 t80 -61.76 -47.7 84.0 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.338 -0.851 . . . . 0.0 109.838 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -57.51 -24.36 55.52 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 120.038 -1.664 . . . . 0.0 110.633 179.528 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.593 HD13 ' HA ' ' A' ' 34' ' ' TYR . 2.3 mp -70.78 -67.55 0.5 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.999 -1.063 . . . . 0.0 110.189 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.445 ' HB2' HG22 ' A' ' 40' ' ' VAL . 11.5 m80 -97.29 -22.12 16.85 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.198 -0.939 . . . . 0.0 110.147 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.572 ' HG3' ' CE1' ' A' ' 35' ' ' TYR . 1.1 tt0 65.27 48.75 2.08 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 121.913 0.863 . . . . 0.0 110.438 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.4 m -142.21 169.54 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 O-C-N 121.294 -0.879 . . . . 0.0 109.012 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.4 p-10 -83.92 150.57 25.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.992 -1.067 . . . . 0.0 108.852 179.299 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.498 ' HG3' ' HD2' ' A' ' 43' ' ' PRO . 64.4 ttt180 -145.08 137.99 13.83 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 120.818 -1.176 . . . . 0.0 110.236 -179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.498 ' HD2' ' HG3' ' A' ' 42' ' ' ARG . 3.3 Cg_exo -59.94 151.18 73.58 Favored 'Trans proline' 0 C--N 1.317 -1.126 0 C-N-CA 122.462 2.108 . . . . 0.0 110.415 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.812 HD22 ' HB2' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -83.14 40.52 0.71 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.06 -1.025 . . . . 0.0 111.144 -179.395 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.4 p -70.78 -10.13 58.86 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.913 -1.117 . . . . 0.0 110.309 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.0 ttm -102.3 -19.42 15.02 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.035 -1.041 . . . . 0.0 110.765 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 1.9 mpt_? -81.64 175.24 10.64 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.856 -1.153 . . . . 0.0 110.171 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.7 166.09 29.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.31 -0.868 . . . . 0.0 109.696 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -58.07 -28.25 64.37 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.309 -0.869 . . . . 0.0 110.342 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -109.17 123.39 6.88 Favored Glycine 0 N--CA 1.497 2.722 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.517 HG21 HG22 ' A' ' 16' ' ' THR . 5.5 mt -53.37 136.6 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.418 -1.048 . . . . 0.0 110.075 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.81 146.27 40.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.505 -0.747 . . . . 0.0 110.001 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.25 158.82 39.44 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.117 -0.989 . . . . 0.0 109.433 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -151.31 -162.39 1.53 Allowed 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -54.13 103.63 0.09 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.841 -1.162 . . . . 0.0 108.921 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -55.73 160.99 2.32 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.55 -0.719 . . . . 0.0 110.672 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.473 -0.767 . . . . 0.0 110.045 179.758 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.791 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.468 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 106.21 -28.61 13.12 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 108.944 -1.662 . . . . 0.0 108.944 -178.768 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.496 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 27.8 m -60.13 92.16 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.409 -1.054 . . . . 0.0 109.524 179.302 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 6' ' ' VAL . 35.3 m -93.33 119.0 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.956 ' HB2' HG22 ' A' ' 12' ' ' THR . 9.3 t -46.8 114.93 0.92 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.454 -0.778 . . . . 0.0 110.809 -178.482 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.4 m -63.13 -14.62 50.76 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.231 -0.918 . . . . 0.0 110.03 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -98.7 -29.16 13.18 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.103 -0.998 . . . . 0.0 110.918 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.601 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 10.4 p -143.16 25.79 1.71 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.649 -1.282 . . . . 0.0 111.456 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.415 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER 37.15 35.54 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.592 -0.693 . . . . 0.0 112.76 178.866 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.956 HG22 ' HB2' ' A' ' 7' ' ' CYS . 9.5 t -88.27 138.27 31.59 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.704 -1.248 . . . . 0.0 109.464 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.3 p -101.13 -19.79 15.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.344 -0.848 . . . . 0.0 109.627 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.447 ' HB ' HG13 ' A' ' 51' ' ' ILE . 12.0 p -108.97 113.08 25.65 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.512 -0.743 . . . . 0.0 109.537 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.626 ' C ' HD11 ' A' ' 51' ' ' ILE . 4.8 p -132.83 147.41 52.3 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.212 -0.93 . . . . 0.0 110.143 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.627 HG22 HG21 ' A' ' 51' ' ' ILE . 29.9 p -73.57 -28.06 61.65 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.501 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 18.8 mt -149.81 120.24 7.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.515 -0.741 . . . . 0.0 109.196 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.468 ' CH2' HG21 ' A' ' 15' ' ' THR . 8.5 m95 -84.68 117.97 24.11 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.427 -0.796 . . . . 0.0 109.796 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.568 ' HD2' ' HA ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -108.7 103.36 12.44 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.156 -0.965 . . . . 0.0 109.14 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.466 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 2.0 mmt180 -77.33 119.61 21.21 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.326 -0.859 . . . . 0.0 109.729 -179.495 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 55.7 m -75.33 149.75 84.57 Favored Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.334 -0.854 . . . . 0.0 110.113 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -53.66 -47.76 25.51 Favored 'Trans proline' 0 C--N 1.321 -0.9 0 C-N-CA 122.793 2.328 . . . . 0.0 111.147 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 7.6 ttt -55.71 -25.55 40.68 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.291 -0.881 . . . . 0.0 109.435 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 114.49 45.62 0.66 Allowed Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -132.11 102.98 14.24 Favored Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.288 -1.125 . . . . 0.0 111.026 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.496 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 2.5 Cg_endo -65.42 105.14 0.7 Allowed 'Trans proline' 0 C--N 1.315 -1.231 0 C-N-CA 122.323 2.015 . . . . 0.0 109.7 178.279 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.539 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -116.45 126.69 74.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.317 -0.864 . . . . 0.0 110.736 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.45 ' HB3' ' CG2' ' A' ' 12' ' ' THR . 8.1 p -49.92 139.91 12.89 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.648 -0.658 . . . . 0.0 109.787 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.568 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 18.2 t-20 -43.13 -46.71 5.95 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.357 -0.839 . . . . 0.0 112.218 -178.39 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -46.43 -45.97 18.44 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.346 -0.846 . . . . 0.0 110.615 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 9.9 m -63.23 -44.92 93.9 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.682 -0.636 . . . . 0.0 109.37 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.47 -49.36 77.94 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.2 mt -67.04 -60.6 2.49 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.473 -1.016 . . . . 0.0 109.938 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.483 ' CE2' ' HD3' ' A' ' 42' ' ' ARG . 50.6 t80 -51.41 -43.24 61.93 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.567 -0.708 . . . . 0.0 109.619 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.531 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 47.6 t80 -53.38 -47.33 69.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.411 -0.806 . . . . 0.0 108.866 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -43.09 99.58 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.057 -1.027 . . . . 0.0 110.358 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 9.6 mp -40.86 -56.62 2.17 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 121.506 -0.747 . . . . 0.0 110.705 -179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.479 ' HB2' HG22 ' A' ' 40' ' ' VAL . 36.4 m80 -115.1 6.46 15.17 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.171 -0.956 . . . . 0.0 110.288 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 35' ' ' TYR . 1.7 tm0? 49.36 34.71 6.77 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.397 -0.815 . . . . 0.0 110.13 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.479 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.7 m -141.05 167.14 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 O-C-N 121.121 -0.987 . . . . 0.0 110.17 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -84.53 156.35 21.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.505 -0.747 . . . . 0.0 109.747 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.508 ' CG ' ' HD2' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -151.08 152.07 30.7 Favored Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.296 -0.878 . . . . 0.0 109.545 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.508 ' HD2' ' CG ' ' A' ' 42' ' ' ARG . 4.6 Cg_exo -55.41 143.78 75.63 Favored 'Trans proline' 0 C--N 1.316 -1.174 0 C-N-CA 122.313 2.009 . . . . 0.0 111.147 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.601 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -95.46 37.71 1.18 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.464 -0.773 . . . . 0.0 110.561 -179.582 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -70.57 -6.64 37.97 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.946 -1.096 . . . . 0.0 110.038 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 38.1 mtp -92.15 -16.0 26.89 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.979 -1.075 . . . . 0.0 110.303 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.58 ' HG2' ' HB2' ' A' ' 44' ' ' LEU . 25.3 mmm180 -56.43 151.28 13.49 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.728 -1.232 . . . . 0.0 109.591 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -139.53 155.35 47.57 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.447 -0.783 . . . . 0.0 109.871 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -49.67 -77.59 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.616 -0.678 . . . . 0.0 110.49 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -83.4 148.4 25.16 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.627 HG21 HG22 ' A' ' 16' ' ' THR . 10.1 mt -54.25 136.89 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.324 -1.104 . . . . 0.0 109.773 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.446 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -75.48 156.0 35.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.552 -0.718 . . . . 0.0 109.836 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.446 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.99 163.01 40.24 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.439 -0.788 . . . . 0.0 109.045 178.835 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.423 ' HA ' ' HD3' ' A' ' 54' ' ' ARG . 15.6 mmt180 -147.67 -165.81 2.36 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -57.35 111.0 0.95 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.823 -1.173 . . . . 0.0 108.863 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -46.21 128.3 9.48 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.332 -0.855 . . . . 0.0 111.111 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt . . . . . 0 N--CA 1.496 1.851 0 O-C-N 121.637 -0.664 . . . . 0.0 109.322 179.469 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.732 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.91 -37.9 2.08 Favored Glycine 0 N--CA 1.495 2.625 0 N-CA-C 108.909 -1.676 . . . . 0.0 108.909 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.417 ' O ' ' CH2' ' A' ' 18' ' ' TRP . 65.8 m -66.53 89.08 0.14 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.362 -1.081 . . . . 0.0 109.264 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 6' ' ' VAL . 28.7 m -85.15 109.72 18.48 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.523 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 53.9 t -45.17 113.55 0.59 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.338 -0.851 . . . . 0.0 110.266 -178.778 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.4 m -63.23 -6.78 4.81 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.366 -0.833 . . . . 0.0 111.285 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.412 ' CG ' HG11 ' A' ' 27' ' ' VAL . 1.6 m120 -102.9 -31.01 10.47 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.795 -1.19 . . . . 0.0 110.728 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.623 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 17.7 p -138.19 18.84 2.78 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.812 -1.18 . . . . 0.0 111.003 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.82 25.51 0.46 Allowed 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.351 -0.843 . . . . 0.0 111.615 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.426 HG22 ' CB ' ' A' ' 7' ' ' CYS . 5.8 t -88.6 132.53 34.5 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.67 -1.268 . . . . 0.0 109.525 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 p -92.68 -6.66 48.77 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.592 -0.693 . . . . 0.0 109.25 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.0 p -112.69 128.86 56.52 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.33 -0.856 . . . . 0.0 109.686 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.547 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 5.4 p -149.07 152.56 36.42 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.059 -1.025 . . . . 0.0 109.883 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.601 HG22 HG21 ' A' ' 51' ' ' ILE . 19.5 p -83.65 -31.06 26.38 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.6 -0.687 . . . . 0.0 109.461 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.669 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 24.9 mt -141.48 87.4 2.07 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.392 -0.818 . . . . 0.0 108.873 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.547 ' CZ2' HG23 ' A' ' 15' ' ' THR . 11.5 m95 -53.32 103.14 0.07 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.247 -0.908 . . . . 0.0 110.357 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.504 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 2.3 tpt180 -88.61 83.94 6.75 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.35 -0.844 . . . . 0.0 109.259 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.8 tpp180 -71.44 114.64 9.72 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.299 -0.876 . . . . 0.0 108.903 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 26.4 p -84.01 139.6 39.85 Favored Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.178 -0.951 . . . . 0.0 109.573 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -55.86 -31.79 82.51 Favored 'Trans proline' 0 C--N 1.319 -1.011 0 C-N-CA 122.589 2.193 . . . . 0.0 111.053 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -23.81 44.88 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.436 -0.79 . . . . 0.0 109.343 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.11 28.19 3.95 Favored Glycine 0 N--CA 1.496 2.664 0 N-CA-C 109.994 -1.242 . . . . 0.0 109.994 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -129.47 99.79 20.65 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.052 -1.263 . . . . 0.0 110.14 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.472 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 Cg_endo -66.09 108.04 1.25 Allowed 'Trans proline' 0 C--N 1.314 -1.278 0 C-N-CA 122.216 1.944 . . . . 0.0 109.818 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.523 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.8 m -121.12 125.9 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.109 -0.994 . . . . 0.0 110.351 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.534 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.9 p -51.4 131.84 29.04 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.56 -0.713 . . . . 0.0 109.514 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.669 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 6.0 t-20 -41.97 -40.37 2.17 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.486 -0.759 . . . . 0.0 111.725 -178.287 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.35 -38.43 53.14 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.113 -0.992 . . . . 0.0 109.79 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.57 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 2.3 m -68.06 -42.22 80.8 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.65 -57.04 17.92 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 30.4 mt -59.71 -42.88 94.06 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.512 -0.993 . . . . 0.0 109.006 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -57.95 -42.58 85.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.353 -0.842 . . . . 0.0 109.268 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.569 ' HB2' ' NE ' ' A' ' 42' ' ' ARG . 41.4 t80 -55.79 -36.3 67.24 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.305 -0.872 . . . . 0.0 110.169 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -79.29 -49.93 11.69 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.75 -1.219 . . . . 0.0 110.092 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -49.34 -33.01 12.4 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.326 -0.859 . . . . 0.0 110.219 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.524 ' CB ' HG22 ' A' ' 40' ' ' VAL . 15.2 m80 -118.3 -6.18 10.82 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.137 -0.977 . . . . 0.0 110.64 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.47 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.4 OUTLIER 50.07 34.88 8.9 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.096 -1.002 . . . . 0.0 109.937 -179.295 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.524 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.4 m -138.71 -169.11 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 O-C-N 121.271 -0.893 . . . . 0.0 109.383 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -176.02 0.05 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.27 -0.894 . . . . 0.0 109.771 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.57 ' HG2' ' O ' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -135.63 86.26 28.87 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.011 -1.056 . . . . 0.0 110.047 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -64.79 147.26 89.52 Favored 'Trans proline' 0 C--N 1.314 -1.279 0 C-N-CA 122.367 2.045 . . . . 0.0 110.46 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.635 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.7 OUTLIER -91.34 12.78 19.32 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.093 -1.004 . . . . 0.0 110.523 179.661 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 p -53.96 -26.12 24.14 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 120.955 -1.091 . . . . 0.0 110.611 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 8.1 ttp -94.61 -6.65 43.0 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.197 -0.939 . . . . 0.0 110.845 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.481 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -81.47 162.4 23.29 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.931 -1.105 . . . . 0.0 110.395 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.534 ' HD2' ' HG3' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -146.18 -173.56 4.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.525 -0.734 . . . . 0.0 109.118 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.71 -9.05 58.18 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.383 -0.823 . . . . 0.0 111.598 -179.315 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -141.53 149.74 21.34 Favored Glycine 0 N--CA 1.501 3.026 0 O-C-N 120.53 -1.356 . . . . 0.0 110.727 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.601 HG21 HG22 ' A' ' 16' ' ' THR . 4.7 mt -63.6 131.76 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.379 -1.071 . . . . 0.0 109.567 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.534 ' HG3' ' HD2' ' A' ' 48' ' ' LYS . 3.6 mt-30 -63.73 136.85 57.77 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.335 -0.853 . . . . 0.0 110.145 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.61 160.67 40.63 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.102 -0.999 . . . . 0.0 109.853 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.51 -155.67 0.63 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -56.39 114.96 2.22 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.835 -1.165 . . . . 0.0 108.503 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -51.78 143.13 13.59 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.508 -0.745 . . . . 0.0 110.773 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt . . . . . 0 N--CA 1.494 1.764 0 O-C-N 121.503 -0.748 . . . . 0.0 109.529 179.558 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.817 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.27 -31.93 8.16 Favored Glycine 0 N--CA 1.495 2.584 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.503 HG23 ' CB ' ' A' ' 26' ' ' PRO . 55.1 m -66.59 93.97 0.27 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.284 -1.127 . . . . 0.0 109.917 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.6 m -100.14 138.73 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.935 ' HB2' HG22 ' A' ' 12' ' ' THR . 12.2 t -58.18 118.79 5.85 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.256 -0.902 . . . . 0.0 110.478 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.2 m -64.11 -12.75 42.36 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.245 -0.909 . . . . 0.0 110.153 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -105.04 -25.46 12.53 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.183 -0.948 . . . . 0.0 110.855 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.567 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 7.5 p -147.9 28.05 0.95 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.657 -1.277 . . . . 0.0 111.12 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 30.69 40.56 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.688 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 178.676 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.935 HG22 ' HB2' ' A' ' 7' ' ' CYS . 12.2 t -90.44 139.7 30.43 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.976 -1.077 . . . . 0.0 108.96 178.833 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -99.0 -24.97 14.72 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.946 -1.096 . . . . 0.0 109.493 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.8 p -101.25 116.06 31.93 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.494 -0.754 . . . . 0.0 109.232 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.425 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 6.2 p -138.49 154.93 48.82 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.028 -1.045 . . . . 0.0 110.037 -179.597 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.492 HG22 ' CG2' ' A' ' 51' ' ' ILE . 40.9 p -74.87 -31.33 61.59 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.149 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.519 ' HA ' HD23 ' A' ' 17' ' ' LEU . 8.8 mt -153.94 125.01 7.32 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -82.04 106.51 14.01 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.628 -0.67 . . . . 0.0 109.979 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.546 ' HB2' ' O ' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -80.91 77.45 7.79 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.071 -1.018 . . . . 0.0 108.985 179.43 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 18.3 tpt180 -61.29 99.62 0.11 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.559 ' HB3' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -60.21 152.03 64.61 Favored Pre-proline 0 N--CA 1.5 2.026 0 O-C-N 121.395 -0.816 . . . . 0.0 109.545 -179.421 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -54.17 -44.21 51.4 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 C-N-CA 122.645 2.23 . . . . 0.0 110.809 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -19.08 64.95 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.255 -0.903 . . . . 0.0 109.731 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.02 41.63 1.16 Allowed Glycine 0 N--CA 1.496 2.678 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.559 ' HB2' ' HB3' ' A' ' 21' ' ' SER . 51.1 m-20 -120.02 96.25 49.32 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.274 -1.133 . . . . 0.0 110.196 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.503 ' CB ' HG23 ' A' ' 5' ' ' THR . 1.3 Cg_endo -68.22 96.44 0.47 Allowed 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.155 1.904 . . . . 0.0 109.838 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.546 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 2.0 m -111.45 122.71 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.064 -1.022 . . . . 0.0 110.549 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.425 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 4.2 p -45.51 129.87 8.63 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.5 -0.75 . . . . 0.0 110.125 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -32.35 -51.37 0.26 Allowed 'General case' 0 N--CA 1.507 2.424 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.245 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.54 -47.85 27.84 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.313 -0.867 . . . . 0.0 111.128 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 14.8 m -60.05 -45.79 91.67 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.381 -0.824 . . . . 0.0 108.87 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.85 -50.17 70.59 Favored Glycine 0 N--CA 1.493 2.463 0 N-CA-C 110.229 -1.148 . . . . 0.0 110.229 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.7 mt -63.9 -62.11 1.85 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.369 -1.077 . . . . 0.0 110.359 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.556 ' CD1' ' HB2' ' A' ' 42' ' ' ARG . 21.0 t80 -51.67 -44.15 62.96 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.317 -0.864 . . . . 0.0 109.177 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.475 ' O ' ' N ' ' A' ' 39' ' ' GLN . 23.4 t80 -50.81 -48.48 59.72 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.573 -0.705 . . . . 0.0 109.41 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.22 -37.98 88.98 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.043 -1.035 . . . . 0.0 110.657 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 34' ' ' TYR . 7.5 mp -46.19 -53.97 9.56 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.05 -1.031 . . . . 0.0 110.008 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.524 ' CB ' HG22 ' A' ' 40' ' ' VAL . 88.1 m-70 -112.05 10.15 20.38 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.268 -0.895 . . . . 0.0 109.73 179.045 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.475 ' N ' ' O ' ' A' ' 35' ' ' TYR . 2.5 tt0 47.62 35.12 4.1 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.4 -0.813 . . . . 0.0 110.136 -178.679 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.524 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.7 m -132.94 -177.9 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 O-C-N 121.517 -0.74 . . . . 0.0 109.385 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -75.59 179.47 5.32 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.278 -0.889 . . . . 0.0 110.661 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.556 ' HB2' ' CD1' ' A' ' 34' ' ' TYR . 10.0 ttp180 -150.19 132.62 8.08 Favored Pre-proline 0 N--CA 1.498 1.957 0 O-C-N 121.198 -0.939 . . . . 0.0 109.787 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.421 ' HD2' ' HG2' ' A' ' 42' ' ' ARG . 1.2 Cg_endo -63.79 149.36 90.92 Favored 'Trans proline' 0 C--N 1.316 -1.154 0 C-N-CA 122.155 1.904 . . . . 0.0 110.657 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.567 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 1.1 pp -85.98 -1.47 57.36 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.02 -1.05 . . . . 0.0 110.245 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 t -61.3 -11.39 9.61 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.119 -0.988 . . . . 0.0 110.856 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.19 -7.36 48.54 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.782 -1.198 . . . . 0.0 110.694 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.595 ' HD3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -74.18 172.92 10.89 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.556 -1.34 . . . . 0.0 110.253 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.403 ' HG3' ' N ' ' A' ' 49' ' ' ASP . 1.9 tppp? -136.61 163.98 29.29 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.25 -0.906 . . . . 0.0 109.3 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.403 ' N ' ' HG3' ' A' ' 48' ' ' LYS . 6.4 t70 -49.09 -80.46 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.478 -0.764 . . . . 0.0 110.351 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.85 161.96 26.1 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.492 ' CG2' HG22 ' A' ' 16' ' ' THR . 5.4 mt -57.06 126.58 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.291 -1.123 . . . . 0.0 109.737 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.15 154.23 42.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.498 -0.751 . . . . 0.0 109.58 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.19 162.41 40.19 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.166 -0.959 . . . . 0.0 109.515 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.405 ' HD2' ' HA ' ' A' ' 54' ' ' ARG . 5.6 mmm180 -150.88 -172.61 4.25 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.54 -0.725 . . . . 0.0 110.421 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.19 79.53 0.97 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.13 -0.981 . . . . 0.0 109.562 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.58 162.2 4.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.604 -0.685 . . . . 0.0 110.41 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.8 pttt . . . . . 0 N--CA 1.498 1.971 0 O-C-N 121.442 -0.786 . . . . 0.0 109.919 179.353 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.798 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.484 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 130.38 -26.67 4.1 Favored Glycine 0 N--CA 1.495 2.624 0 N-CA-C 109.275 -1.53 . . . . 0.0 109.275 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.541 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 98.5 m -59.46 91.7 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.277 -1.131 . . . . 0.0 109.349 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 6' ' ' VAL . 21.0 m -83.91 111.0 19.26 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.049 -1.032 . . . . 0.0 108.261 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.487 ' CB ' HG22 ' A' ' 12' ' ' THR . 40.8 t -48.24 109.5 0.24 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.438 -0.789 . . . . 0.0 110.158 -178.733 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.6 m -58.29 -12.15 3.42 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.43 -0.794 . . . . 0.0 111.368 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.477 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.9 OUTLIER -96.16 -30.67 13.38 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.965 -1.084 . . . . 0.0 110.793 -179.68 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.594 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 17.4 p -141.03 19.3 2.28 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.661 -1.274 . . . . 0.0 111.41 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 47.5 25.61 0.66 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.321 -0.862 . . . . 0.0 111.768 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.487 HG22 ' CB ' ' A' ' 7' ' ' CYS . 8.1 t -87.49 132.96 33.84 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.81 -1.181 . . . . 0.0 109.816 179.36 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 94.8 p -90.24 -23.15 21.32 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.3 p -98.99 130.91 45.36 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.61 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 12.9 p -148.82 138.44 21.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.271 -0.893 . . . . 0.0 109.646 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.565 HG23 ' CG2' ' A' ' 51' ' ' ILE . 2.5 p -64.15 -34.87 79.05 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.61 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 46.7 mt -144.48 104.78 4.1 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 121.401 0.62 . . . . 0.0 109.5 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.61 ' CZ3' HG21 ' A' ' 15' ' ' THR . 6.5 m95 -62.56 99.93 0.17 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.191 -0.943 . . . . 0.0 109.85 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -83.94 82.08 8.5 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.395 -0.815 . . . . 0.0 108.954 179.568 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.443 ' NH1' ' HG3' ' A' ' 26' ' ' PRO . 4.1 tpp180 -63.06 96.14 0.09 Allowed 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -58.81 133.6 86.64 Favored Pre-proline 0 N--CA 1.495 1.798 0 O-C-N 121.385 -0.822 . . . . 0.0 110.289 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -56.4 -33.08 91.0 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 C-N-CA 122.517 2.145 . . . . 0.0 110.556 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -23.91 31.58 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.386 -0.821 . . . . 0.0 109.767 178.834 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.49 26.95 3.24 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -132.63 112.39 13.86 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 120.959 -1.318 . . . . 0.0 110.408 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.541 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 1.1 Cg_endo -67.95 105.95 1.24 Allowed 'Trans proline' 0 C--N 1.313 -1.321 0 C-N-CA 122.09 1.86 . . . . 0.0 109.474 178.442 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.478 ' O ' ' HB3' ' A' ' 19' ' ' ARG . 2.1 m -121.56 127.27 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.086 -1.009 . . . . 0.0 110.246 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.494 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.4 p -48.98 132.28 18.71 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.457 -0.777 . . . . 0.0 109.09 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.61 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.8 t-20 -35.7 -48.09 0.52 Allowed 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.685 -0.634 . . . . 0.0 111.761 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -45.42 -51.67 11.1 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.346 -0.847 . . . . 0.0 110.9 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 32.8 m -61.28 -47.99 83.44 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.395 -0.816 . . . . 0.0 109.243 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.07 -33.56 75.06 Favored Glycine 0 N--CA 1.497 2.75 0 N-CA-C 110.841 -0.903 . . . . 0.0 110.841 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 68.0 mt -74.16 -62.45 1.51 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.252 -1.146 . . . . 0.0 110.19 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.634 ' HA ' HD22 ' A' ' 37' ' ' LEU . 25.0 t80 -55.52 -40.66 72.07 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.102 -0.999 . . . . 0.0 108.917 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.467 ' O ' ' N ' ' A' ' 39' ' ' GLN . 40.9 t80 -54.89 -46.13 74.77 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 0.0 109.675 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -61.36 -32.85 72.76 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.761 -1.212 . . . . 0.0 110.3 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.634 HD22 ' HA ' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -57.95 -62.13 2.03 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.214 -0.928 . . . . 0.0 110.863 -179.338 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.499 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 61.5 m80 -105.0 9.8 34.34 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.011 -1.056 . . . . 0.0 110.364 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.3 OUTLIER 50.05 27.47 2.51 Favored 'General case' 0 N--CA 1.505 2.303 0 CA-C-O 121.589 0.709 . . . . 0.0 110.685 -179.117 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' CB ' ' A' ' 38' ' ' HIS . 6.2 m -130.94 160.95 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 O-C-N 121.237 -0.914 . . . . 0.0 110.19 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -79.87 162.49 24.99 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.371 0.605 . . . . 0.0 110.101 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.487 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -145.98 150.49 42.51 Favored Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.298 -0.876 . . . . 0.0 109.954 179.509 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -59.11 146.77 93.27 Favored 'Trans proline' 0 C--N 1.315 -1.213 0 C-N-CA 122.534 2.156 . . . . 0.0 111.031 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.594 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -83.93 37.21 0.59 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.297 -0.877 . . . . 0.0 110.865 -179.866 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.0 p -68.14 -8.38 38.02 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.007 -1.058 . . . . 0.0 110.293 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.3 mmm -93.0 -20.26 20.76 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.11 -0.994 . . . . 0.0 110.304 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.548 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -66.77 142.68 57.29 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.88 -1.137 . . . . 0.0 109.614 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -131.59 -155.42 0.69 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.35 -0.844 . . . . 0.0 109.53 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.15 -84.85 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.453 -0.779 . . . . 0.0 110.644 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -110.52 170.45 14.02 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.281 -1.527 . . . . 0.0 109.281 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.565 ' CG2' HG23 ' A' ' 16' ' ' THR . 5.3 mt -52.6 130.15 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.259 -1.142 . . . . 0.0 110.256 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.48 165.69 24.78 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.496 0.665 . . . . 0.0 109.545 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.88 166.52 29.29 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.292 -0.88 . . . . 0.0 109.287 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.67 -168.05 3.0 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.509 -0.744 . . . . 0.0 109.749 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.72 113.02 11.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.103 -0.998 . . . . 0.0 108.835 179.365 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.453 ' HG3' ' N ' ' A' ' 57' ' ' LYS . 2.7 ttp180 -51.43 151.69 2.94 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.451 -0.781 . . . . 0.0 109.964 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 57' ' ' LYS . . . . . 0.453 ' N ' ' HG3' ' A' ' 56' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.798 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 101.07 -46.66 1.28 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 108.635 -1.786 . . . . 0.0 108.635 -178.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.476 HG22 ' CH2' ' A' ' 18' ' ' TRP . 53.1 m -83.13 93.38 7.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.137 -1.213 . . . . 0.0 108.844 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.6 m -98.21 121.13 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.521 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 46.5 t -50.22 113.56 0.9 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.374 -0.829 . . . . 0.0 110.151 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.6 m -62.95 -11.84 21.44 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.139 -0.976 . . . . 0.0 111.112 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.478 ' OD1' HG11 ' A' ' 27' ' ' VAL . 6.5 m-20 -95.53 -31.68 13.21 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.911 -1.118 . . . . 0.0 110.747 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.517 ' SG ' HG22 ' A' ' 12' ' ' THR . 16.4 p -139.5 18.33 2.55 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.781 -1.199 . . . . 0.0 110.946 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.441 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 48.18 24.93 0.73 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.269 -0.894 . . . . 0.0 112.246 178.815 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.517 HG22 ' SG ' ' A' ' 10' ' ' CYS . 14.6 t -87.35 135.18 33.42 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.602 -1.312 . . . . 0.0 110.061 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.4 p -90.13 -16.14 30.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.487 -0.758 . . . . 0.0 109.145 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 44.9 p -102.92 129.56 49.68 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.289 -0.882 . . . . 0.0 108.713 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.564 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 7.0 p -146.36 148.76 32.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.204 -0.935 . . . . 0.0 110.092 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.8 p -72.03 -37.25 69.78 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 179.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.487 ' HA ' HD23 ' A' ' 17' ' ' LEU . 10.3 mt -147.07 105.55 3.8 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.564 ' CZ3' HG21 ' A' ' 15' ' ' THR . 11.4 m95 -59.51 98.62 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.466 -0.771 . . . . 0.0 110.306 -179.146 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.67 75.91 3.34 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.326 -0.859 . . . . 0.0 108.784 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.415 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.08 94.75 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.4 139.97 96.52 Favored Pre-proline 0 N--CA 1.499 1.992 0 O-C-N 121.44 -0.788 . . . . 0.0 110.429 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -53.98 -39.15 86.18 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 C-N-CA 122.832 2.355 . . . . 0.0 111.184 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -22.43 48.44 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.273 -0.892 . . . . 0.0 109.69 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.77 32.81 2.57 Favored Glycine 0 N--CA 1.498 2.77 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -128.04 98.13 27.79 Favored Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.167 -1.196 . . . . 0.0 110.076 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.521 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.1 Cg_endo -65.08 112.88 2.18 Favored 'Trans proline' 0 C--N 1.312 -1.381 0 C-N-CA 122.26 1.973 . . . . 0.0 110.191 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.478 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.2 m -124.28 131.2 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.151 -0.968 . . . . 0.0 109.953 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.497 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 6.1 p -53.67 134.73 41.62 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.43 0.633 . . . . 0.0 109.763 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -36.87 -44.73 0.51 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.724 -0.61 . . . . 0.0 112.075 -178.455 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.79 -47.81 59.64 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.331 -0.855 . . . . 0.0 110.187 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 55.9 m -68.36 -39.51 81.79 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.143 -0.973 . . . . 0.0 109.116 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.07 -36.91 69.25 Favored Glycine 0 N--CA 1.497 2.751 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 61.8 mt -80.17 -58.29 3.22 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.312 -1.11 . . . . 0.0 110.107 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.579 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 23.6 t80 -51.61 -36.69 46.75 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.541 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 17.9 t80 -59.79 -51.7 68.61 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.312 -0.867 . . . . 0.0 109.56 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -52.75 -26.15 13.3 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.664 -1.273 . . . . 0.0 110.353 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.4 mp -72.45 -66.33 0.67 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.961 -1.087 . . . . 0.0 110.381 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.45 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 77.5 m-70 -94.6 -26.57 16.31 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.992 -1.067 . . . . 0.0 110.797 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.541 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 75.56 25.53 1.21 Allowed 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 121.588 0.709 . . . . 0.0 111.374 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -124.63 167.02 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 120.941 -1.099 . . . . 0.0 110.431 179.049 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.6 p-10 -85.66 131.13 34.4 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.333 -0.854 . . . . 0.0 109.417 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.579 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 25.3 mmt180 -109.16 149.13 39.29 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.088 -1.008 . . . . 0.0 110.325 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.07 150.9 84.78 Favored 'Trans proline' 0 C--N 1.314 -1.263 0 C-N-CA 122.372 2.048 . . . . 0.0 110.431 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.617 HD13 ' CZ ' ' A' ' 47' ' ' ARG . 0.7 OUTLIER -74.33 29.83 0.08 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.187 -0.946 . . . . 0.0 111.231 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.7 p -67.97 -17.97 64.59 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.458 -1.401 . . . . 0.0 109.483 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.52 2.73 52.71 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.392 -0.818 . . . . 0.0 109.929 179.28 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.617 ' CZ ' HD13 ' A' ' 44' ' ' LEU . 3.0 ttp180 -67.39 173.11 4.24 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.897 -1.127 . . . . 0.0 109.51 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.76 164.85 37.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.165 -0.96 . . . . 0.0 109.773 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -44.43 -70.25 0.11 Allowed 'General case' 0 N--CA 1.504 2.236 0 CA-C-O 121.419 0.628 . . . . 0.0 109.626 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -121.38 175.16 16.12 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 108.632 -1.787 . . . . 0.0 108.632 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.524 HD11 ' O ' ' A' ' 15' ' ' THR . 4.8 mt -51.39 124.73 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.277 -1.131 . . . . 0.0 109.706 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.404 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -70.27 160.63 31.84 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.306 -0.871 . . . . 0.0 108.654 179.238 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.404 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.95 165.54 36.16 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.085 -1.01 . . . . 0.0 108.996 179.478 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -143.55 -178.33 5.84 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.213 -0.929 . . . . 0.0 109.523 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -52.15 123.67 11.18 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.31 -0.869 . . . . 0.0 108.722 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -48.41 113.48 0.76 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.61 -0.682 . . . . 0.0 109.43 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.2 ttpt . . . . . 0 N--CA 1.496 1.871 0 O-C-N 121.572 -0.705 . . . . 0.0 109.201 -179.622 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 115.23 -24.35 10.67 Favored Glycine 0 N--CA 1.496 2.687 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 -179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.495 HG23 ' HB2' ' A' ' 26' ' ' PRO . 30.7 m -71.96 92.38 1.27 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.873 -1.369 . . . . 0.0 109.309 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.6 m -93.54 117.03 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.51 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 44.7 t -45.51 112.37 0.45 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.446 -0.784 . . . . 0.0 110.409 -178.99 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 39.4 m -62.5 -8.94 7.09 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.429 -0.795 . . . . 0.0 111.305 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -104.96 -26.69 12.07 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.797 -1.189 . . . . 0.0 111.199 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.603 ' HA ' ' HB3' ' A' ' 44' ' ' LEU . 13.1 p -139.67 17.14 2.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.693 -1.254 . . . . 0.0 111.334 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 49.55 22.13 0.71 Allowed 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.237 -0.914 . . . . 0.0 111.995 178.723 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.537 ' HB ' ' SG ' ' A' ' 10' ' ' CYS . 2.0 t -90.04 125.48 35.42 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.799 -1.188 . . . . 0.0 109.473 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.4 p -88.95 -21.66 23.46 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.377 -0.827 . . . . 0.0 109.38 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.4 p -89.52 117.21 28.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.359 -0.838 . . . . 0.0 109.001 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.63 HG21 ' CH2' ' A' ' 18' ' ' TRP . 6.3 p -144.86 147.51 32.9 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.923 -1.111 . . . . 0.0 110.475 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 77.0 p -80.05 -30.37 39.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.541 -0.724 . . . . 0.0 109.08 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.665 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -144.45 112.02 6.12 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.184 -0.947 . . . . 0.0 109.312 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.63 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.5 m95 -74.67 90.9 2.32 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.107 -0.995 . . . . 0.0 109.749 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.15 83.08 3.64 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.384 -0.822 . . . . 0.0 109.377 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.461 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.6 mmt180 -66.41 110.05 2.96 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.151 -0.968 . . . . 0.0 109.348 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 83.1 p -71.03 149.24 94.74 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.212 -0.93 . . . . 0.0 109.465 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -56.11 -22.34 39.24 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 122.432 2.088 . . . . 0.0 111.229 -179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -75.23 -3.43 33.12 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.196 -0.94 . . . . 0.0 110.169 179.203 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.9 34.41 9.0 Favored Glycine 0 N--CA 1.495 2.597 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -127.47 101.4 24.53 Favored Pre-proline 0 N--CA 1.494 1.741 0 O-C-N 121.458 -1.025 . . . . 0.0 110.43 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.51 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.3 Cg_endo -65.37 105.02 0.68 Allowed 'Trans proline' 0 C--N 1.315 -1.22 0 C-N-CA 122.593 2.195 . . . . 0.0 110.099 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.499 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.74 124.98 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.131 -0.981 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.489 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.0 p -49.19 131.2 19.7 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.459 0.647 . . . . 0.0 110.074 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.665 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 23.5 t-20 -37.18 -48.84 0.87 Allowed 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.629 -0.669 . . . . 0.0 111.548 -178.96 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -45.04 -44.08 9.86 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.425 -0.797 . . . . 0.0 110.296 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.525 ' HB3' ' HD3' ' A' ' 42' ' ' ARG . 3.4 m -64.03 -44.79 91.46 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.29 -33.24 85.46 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.496 ' O ' HD13 ' A' ' 37' ' ' LEU . 41.6 mt -76.33 -60.45 2.33 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.471 -1.017 . . . . 0.0 109.617 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.833 ' HA ' HD22 ' A' ' 37' ' ' LEU . 51.3 t80 -48.05 -38.88 18.39 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.303 -0.873 . . . . 0.0 109.289 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.495 ' CD2' ' O ' ' A' ' 40' ' ' VAL . 58.3 t80 -54.24 -53.9 47.37 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.439 -0.788 . . . . 0.0 109.602 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.04 -38.11 89.89 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.113 -0.992 . . . . 0.0 110.459 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.833 HD22 ' HA ' ' A' ' 34' ' ' TYR . 4.1 mp -42.77 -57.5 2.74 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.437 -0.79 . . . . 0.0 110.353 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.685 ' HB2' HG22 ' A' ' 40' ' ' VAL . 22.3 m80 -118.3 13.69 13.7 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.286 -0.884 . . . . 0.0 109.705 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.47 ' N ' ' O ' ' A' ' 35' ' ' TYR . 17.6 tt0 45.76 47.33 11.9 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 121.842 0.83 . . . . 0.0 109.788 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.685 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.1 m -130.86 -170.82 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 121.545 -0.722 . . . . 0.0 109.71 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -61.69 -173.62 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.267 -0.896 . . . . 0.0 110.177 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.525 ' HD3' ' HB3' ' A' ' 31' ' ' CYS . 29.7 mtt180 -130.0 93.55 33.5 Favored Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 121.1 -1.0 . . . . 0.0 109.976 -179.207 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.561 ' HD2' ' CE1' ' A' ' 34' ' ' TYR . 5.0 Cg_exo -58.75 126.63 21.78 Favored 'Trans proline' 0 C--N 1.318 -1.061 0 C-N-CA 122.559 2.173 . . . . 0.0 110.866 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.603 ' HB3' ' HA ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -96.88 17.32 17.03 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.45 -0.781 . . . . 0.0 110.586 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.2 p -74.16 -4.57 36.6 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.996 -1.065 . . . . 0.0 110.198 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -103.91 -0.66 28.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.082 -1.011 . . . . 0.0 110.626 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 9.4 mmm180 -51.13 141.36 14.44 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.628 -1.295 . . . . 0.0 110.215 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmm -119.38 -163.99 1.02 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.514 -0.741 . . . . 0.0 109.52 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -79.51 -89.35 0.06 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.209 -0.932 . . . . 0.0 110.175 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -96.11 165.91 24.34 Favored Glycine 0 N--CA 1.499 2.864 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.405 HD11 ' C ' ' A' ' 15' ' ' THR . 5.4 mt -54.3 129.06 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.246 -1.15 . . . . 0.0 109.767 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -70.33 141.91 52.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.297 -0.877 . . . . 0.0 109.275 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.72 158.13 40.54 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.946 -1.097 . . . . 0.0 110.159 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.471 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 1.1 mtm-85 -153.16 -158.47 0.89 Allowed 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -58.37 106.11 0.35 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.04 139.29 4.54 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.521 0.677 . . . . 0.0 110.94 -178.475 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 O-C-N 121.581 -0.699 . . . . 0.0 109.949 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.88 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.474 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 94.35 -37.13 3.49 Favored Glycine 0 N--CA 1.497 2.759 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.315 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.4 m -60.61 96.37 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.273 -1.134 . . . . 0.0 109.231 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.474 HG13 ' O ' ' A' ' 4' ' ' GLY . 20.8 m -96.94 138.72 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.532 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 22.1 t -59.88 122.67 14.82 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.425 -0.797 . . . . 0.0 110.835 -178.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -65.45 -16.04 63.24 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.193 -0.942 . . . . 0.0 109.965 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -104.11 -19.17 14.26 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.031 -1.043 . . . . 0.0 111.209 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.517 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 9.0 p -154.0 26.28 0.48 Allowed 'General case' 0 N--CA 1.502 2.154 0 O-C-N 120.63 -1.294 . . . . 0.0 111.151 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.658 ' OE1' HD13 ' A' ' 44' ' ' LEU . 1.0 OUTLIER 31.15 37.11 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.642 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 178.901 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.591 HG23 HG22 ' A' ' 15' ' ' THR . 5.5 t -90.39 131.85 35.93 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.565 -1.335 . . . . 0.0 108.794 178.586 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 91.6 p -89.39 -26.37 21.06 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.447 -0.783 . . . . 0.0 109.426 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.5 p -99.51 113.3 25.6 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.485 -0.76 . . . . 0.0 109.124 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.591 HG22 HG23 ' A' ' 12' ' ' THR . 6.8 p -132.96 164.29 27.29 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.31 -0.869 . . . . 0.0 110.197 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.5 p -74.85 -45.95 39.67 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.517 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.415 ' HA ' HD23 ' A' ' 17' ' ' LEU . 12.8 mt -147.57 116.49 6.8 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.691 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -64.96 98.92 0.31 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.475 -0.765 . . . . 0.0 110.112 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.88 75.38 6.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.514 -0.741 . . . . 0.0 109.62 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.9 tpp180 -64.2 95.59 0.13 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.277 -0.889 . . . . 0.0 108.976 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.14 147.13 47.38 Favored Pre-proline 0 N--CA 1.499 2.017 0 O-C-N 121.437 -0.789 . . . . 0.0 110.133 -179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -56.16 -33.66 91.01 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.383 2.055 . . . . 0.0 110.696 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.8 mtm -60.32 -23.15 63.98 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.214 -0.929 . . . . 0.0 109.537 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.89 45.64 1.01 Allowed Glycine 0 N--CA 1.497 2.733 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -134.84 104.26 10.77 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.468 -1.019 . . . . 0.0 110.277 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.508 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 Cg_endo -66.13 87.59 0.25 Allowed 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 122.317 2.011 . . . . 0.0 109.639 178.918 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.532 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -109.53 124.48 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.111 -0.993 . . . . 0.0 110.371 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.553 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.5 p -46.25 134.28 8.82 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.744 -0.597 . . . . 0.0 109.591 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.419 ' C ' ' O ' ' A' ' 28' ' ' CYS . 2.2 t-20 -34.74 -46.29 0.29 Allowed 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.747 -0.595 . . . . 0.0 111.46 -179.006 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.418 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -47.66 -51.81 20.33 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.509 -0.745 . . . . 0.0 111.27 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.533 ' HA ' ' HD3' ' A' ' 42' ' ' ARG . 52.0 m -62.35 -40.86 97.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.148 -0.97 . . . . 0.0 109.885 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.11 -35.69 91.86 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.446 HD23 ' HA ' ' A' ' 33' ' ' LEU . 83.6 mt -73.69 -62.19 1.58 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.294 -1.121 . . . . 0.0 109.717 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.475 ' CE1' ' HB3' ' A' ' 42' ' ' ARG . 32.1 t80 -51.71 -38.36 54.86 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.547 ' O ' ' N ' ' A' ' 39' ' ' GLN . 32.1 t80 -64.28 -43.72 93.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.465 -0.772 . . . . 0.0 110.118 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HD2' ' CD1' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -60.44 -21.92 62.84 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 119.988 -1.695 . . . . 0.0 110.059 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.54 ' CD1' ' HD2' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -84.74 -59.18 2.43 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.074 -1.016 . . . . 0.0 110.087 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 10.1 m80 -93.03 -28.48 16.36 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.21 -0.931 . . . . 0.0 109.695 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 35' ' ' TYR . 4.7 tt0 61.86 47.8 5.8 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 122.262 1.029 . . . . 0.0 109.999 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -141.17 168.56 15.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -71.4 125.75 27.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.788 -1.195 . . . . 0.0 108.429 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.533 ' HD3' ' HA ' ' A' ' 31' ' ' CYS . 1.8 ptm180 -95.5 146.99 32.3 Favored Pre-proline 0 N--CA 1.493 1.706 0 O-C-N 121.229 -0.919 . . . . 0.0 109.496 -178.873 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.572 ' HB2' HG22 ' A' ' 45' ' ' THR . 1.8 Cg_endo -62.71 133.53 42.66 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 C-N-CA 122.196 1.93 . . . . 0.0 110.565 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.658 HD13 ' OE1' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -76.51 -6.93 53.95 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.468 -0.77 . . . . 0.0 110.375 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.572 HG22 ' HB2' ' A' ' 43' ' ' PRO . 14.6 t -60.66 -28.09 68.31 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.12 -0.987 . . . . 0.0 110.798 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -77.54 -21.44 52.6 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.916 -1.115 . . . . 0.0 110.178 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.57 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -76.08 149.72 37.41 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.022 -1.049 . . . . 0.0 108.997 179.417 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.407 ' N ' ' HG2' ' A' ' 47' ' ' ARG . 34.8 mttm -124.84 -166.07 1.48 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.016 -1.052 . . . . 0.0 110.013 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -91.69 -45.56 8.38 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.072 -1.017 . . . . 0.0 109.9 -179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -95.08 135.46 12.42 Favored Glycine 0 N--CA 1.499 2.873 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.8 mt -50.62 120.97 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.164 -1.197 . . . . 0.0 109.802 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -63.39 151.14 41.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.632 -0.667 . . . . 0.0 109.895 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.451 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -156.32 154.98 31.46 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.977 -1.077 . . . . 0.0 109.366 178.853 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 53' ' ' THR . 5.9 mtp180 -150.89 -161.87 1.43 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -53.25 130.73 35.67 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.928 -1.107 . . . . 0.0 109.136 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.3 mtt180 -76.14 160.43 29.75 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.418 -0.801 . . . . 0.0 110.125 -179.053 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.692 0 O-C-N 121.358 -0.839 . . . . 0.0 109.722 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.51 -30.66 9.2 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 109.211 -1.555 . . . . 0.0 109.211 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.612 HG23 ' HB2' ' A' ' 26' ' ' PRO . 15.5 m -70.77 89.09 0.74 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -1.17 . . . . 0.0 109.627 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 6' ' ' VAL . 20.3 m -97.06 124.11 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 7.9 t -43.66 113.99 0.58 Allowed 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.395 -0.816 . . . . 0.0 111.269 -178.523 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.3 m -59.62 -10.65 3.75 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.106 -0.996 . . . . 0.0 111.178 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -110.4 -28.66 8.46 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.812 -1.18 . . . . 0.0 110.956 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.568 ' O ' ' HD3' ' A' ' 47' ' ' ARG . 2.4 p -138.32 21.97 2.77 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 120.877 -1.139 . . . . 0.0 110.159 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER 30.53 37.57 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 179.272 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.453 ' O ' HG23 ' A' ' 12' ' ' THR . 14.9 t -90.83 126.22 35.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.783 -1.198 . . . . 0.0 109.072 178.777 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 p -89.66 -15.01 33.6 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.51 -0.744 . . . . 0.0 109.699 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -102.7 99.77 9.76 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.287 -0.883 . . . . 0.0 109.386 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.463 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 6.5 p -122.6 163.05 20.71 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.175 -0.953 . . . . 0.0 110.292 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.555 HG22 HG21 ' A' ' 51' ' ' ILE . 81.9 p -94.11 -32.17 13.87 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.658 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 67.5 mt -142.75 87.23 1.98 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.317 -0.864 . . . . 0.0 109.263 179.119 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.463 ' CZ2' HG23 ' A' ' 15' ' ' THR . 13.1 m95 -54.54 109.27 0.48 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.077 -1.014 . . . . 0.0 110.162 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -101.66 130.23 47.98 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.348 -0.845 . . . . 0.0 109.018 179.658 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.9 mmt180 -97.27 109.62 22.34 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.248 -0.908 . . . . 0.0 108.875 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.74 146.5 98.49 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.177 -0.952 . . . . 0.0 109.392 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -58.1 -21.09 49.17 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 C-N-CA 122.2 1.934 . . . . 0.0 110.613 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 10.8 mtt -81.54 -0.96 44.43 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.317 -0.864 . . . . 0.0 109.788 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.89 35.43 7.73 Favored Glycine 0 N--CA 1.497 2.711 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -124.22 105.24 31.47 Favored Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.386 -1.067 . . . . 0.0 110.524 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.612 ' HB2' HG23 ' A' ' 5' ' ' THR . 1.5 Cg_endo -66.63 93.27 0.31 Allowed 'Trans proline' 0 C--N 1.314 -1.27 0 C-N-CA 122.235 1.957 . . . . 0.0 109.579 178.611 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.534 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -109.75 124.47 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 121.107 -0.996 . . . . 0.0 110.561 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.426 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.4 p -45.97 131.43 9.72 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.753 -0.592 . . . . 0.0 110.398 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.658 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 7.2 t-20 -36.63 -45.56 0.53 Allowed 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.708 -0.62 . . . . 0.0 111.934 -178.869 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.24 -49.05 34.77 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.563 -0.711 . . . . 0.0 109.93 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.618 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 8.9 m -59.65 -46.35 89.27 Favored 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -55.03 -54.6 32.83 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.525 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 96.0 mt -59.23 -57.62 12.24 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.644 -0.915 . . . . 0.0 109.594 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.417 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 30.6 t80 -43.8 -36.4 2.29 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.339 -0.851 . . . . 0.0 109.59 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.49 ' O ' ' N ' ' A' ' 39' ' ' GLN . 38.7 t80 -58.82 -52.81 64.12 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.333 -0.854 . . . . 0.0 109.722 178.904 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -65.65 -26.97 68.05 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.964 -1.085 . . . . 0.0 110.483 -179.945 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.494 HD13 ' O ' ' A' ' 33' ' ' LEU . 9.8 mp -53.53 -57.69 9.82 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.215 -0.928 . . . . 0.0 109.285 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.501 ' CB ' HG22 ' A' ' 40' ' ' VAL . 76.8 m-70 -113.79 11.65 18.07 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.18 -0.95 . . . . 0.0 109.771 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.49 ' N ' ' O ' ' A' ' 35' ' ' TYR . 4.9 tm0? 51.92 30.93 7.77 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.362 -0.836 . . . . 0.0 110.018 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.501 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.2 m -131.38 -171.29 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.35 -0.844 . . . . 0.0 109.516 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -66.72 -173.2 0.21 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.249 -0.907 . . . . 0.0 110.105 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.618 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -142.78 116.62 6.3 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.102 -0.999 . . . . 0.0 109.702 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -63.37 147.79 93.25 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 C-N-CA 122.069 1.846 . . . . 0.0 110.302 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.37 16.71 9.61 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.199 -0.938 . . . . 0.0 110.392 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.06 -12.95 60.21 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.054 -1.029 . . . . 0.0 109.858 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 46' ' ' MET . . . . . 0.424 ' O ' ' HG3' ' A' ' 46' ' ' MET . 0.0 OUTLIER -89.36 -5.23 57.65 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.034 -1.041 . . . . 0.0 110.664 179.632 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.568 ' HD3' ' O ' ' A' ' 10' ' ' CYS . 65.6 mtm180 -57.27 165.25 1.48 Allowed 'General case' 0 N--CA 1.504 2.236 0 O-C-N 120.65 -1.281 . . . . 0.0 110.571 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.22 145.62 31.39 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.421 -0.799 . . . . 0.0 109.926 179.036 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -47.6 -36.57 10.96 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.636 -0.665 . . . . 0.0 110.01 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.0 146.84 18.76 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 108.48 -1.848 . . . . 0.0 108.48 179.042 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.555 HG21 HG22 ' A' ' 16' ' ' THR . 5.3 mt -46.73 114.79 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 121.474 -1.015 . . . . 0.0 110.016 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -51.55 142.32 14.37 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.579 -0.701 . . . . 0.0 109.497 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.36 159.09 39.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.96 -1.087 . . . . 0.0 110.054 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.57 -157.65 0.83 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -62.74 97.18 0.1 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 120.884 -1.135 . . . . 0.0 108.726 179.048 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' ARG . . . . . 0.439 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 0.2 OUTLIER -45.06 143.59 1.51 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.678 -0.639 . . . . 0.0 110.473 -179.114 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.887 0 O-C-N 121.397 -0.814 . . . . 0.0 110.086 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.32 -19.67 50.99 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.598 HG23 ' HB2' ' A' ' 26' ' ' PRO . 54.5 m -69.19 87.84 0.42 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.049 -1.266 . . . . 0.0 109.249 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 6' ' ' VAL . 34.6 m -78.8 110.12 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.5 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 41.0 t -47.44 109.44 0.22 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.262 -0.899 . . . . 0.0 110.391 -178.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 24.7 m -59.39 -12.49 6.03 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.326 -0.859 . . . . 0.0 111.628 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.7 ' OD1' HG11 ' A' ' 27' ' ' VAL . 2.1 m120 -95.61 -28.84 14.64 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.612 -1.305 . . . . 0.0 111.059 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.644 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 15.0 p -142.37 17.22 2.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.863 -1.148 . . . . 0.0 111.494 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 4.3 mp0 53.43 18.65 1.4 Allowed 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.2 -0.937 . . . . 0.0 112.052 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.575 HG22 ' SG ' ' A' ' 10' ' ' CYS . 14.5 t -84.15 128.72 34.74 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.401 -1.437 . . . . 0.0 109.786 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.2 p -89.72 -28.46 19.39 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.444 -0.785 . . . . 0.0 109.533 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.436 ' HB ' HG13 ' A' ' 51' ' ' ILE . 27.9 p -93.32 127.44 38.92 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.647 ' O ' HD11 ' A' ' 51' ' ' ILE . 4.8 p -146.44 145.49 30.25 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.034 -1.041 . . . . 0.0 110.097 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.472 HG22 HG23 ' A' ' 51' ' ' ILE . 25.1 p -68.0 -32.06 72.18 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.104 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 13.5 mt -149.03 122.6 9.15 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.332 -0.855 . . . . 0.0 109.57 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.565 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.8 m95 -80.89 109.13 15.17 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.302 -0.874 . . . . 0.0 110.255 -179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.09 78.69 4.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.39 -0.819 . . . . 0.0 108.904 179.452 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.8 122.9 15.99 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.216 -0.927 . . . . 0.0 109.872 -179.554 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.7 143.26 37.95 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.592 -0.693 . . . . 0.0 109.518 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -56.86 -38.82 94.98 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.496 2.13 . . . . 0.0 110.742 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.36 -23.73 50.83 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.405 -0.809 . . . . 0.0 109.586 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.78 39.06 1.63 Allowed Glycine 0 N--CA 1.496 2.658 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -133.18 97.15 16.73 Favored Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.397 -1.061 . . . . 0.0 110.177 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.598 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.9 Cg_endo -63.98 112.68 1.91 Allowed 'Trans proline' 0 C--N 1.312 -1.387 0 C-N-CA 122.091 1.861 . . . . 0.0 109.952 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.7 HG11 ' OD1' ' A' ' 9' ' ' ASN . 3.3 m -122.62 129.1 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.074 -1.017 . . . . 0.0 110.5 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.522 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.2 p -52.68 139.2 26.84 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 121.441 0.638 . . . . 0.0 110.559 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 19.7 t-20 -40.35 -47.78 2.58 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.88 -0.512 . . . . 0.0 112.071 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.43 -41.68 52.91 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.195 -0.941 . . . . 0.0 110.355 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.409 ' HB3' ' HD2' ' A' ' 42' ' ' ARG . 9.6 m -66.77 -36.81 83.29 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.156 -0.965 . . . . 0.0 108.526 178.72 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.81 -48.79 59.24 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.436 ' O ' HD13 ' A' ' 37' ' ' LEU . 93.8 mt -61.04 -59.44 5.36 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.583 -0.951 . . . . 0.0 109.619 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.487 ' CD1' ' HB3' ' A' ' 42' ' ' ARG . 18.4 t80 -47.97 -40.35 22.07 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.564 -0.71 . . . . 0.0 109.515 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.446 ' HB2' ' NH1' ' A' ' 42' ' ' ARG . 41.4 t80 -58.33 -49.9 75.53 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.313 -0.867 . . . . 0.0 109.62 179.209 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 tttt -61.14 -34.66 75.36 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.979 -1.076 . . . . 0.0 109.945 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.436 HD13 ' O ' ' A' ' 33' ' ' LEU . 9.1 mp -53.62 -63.27 1.2 Allowed 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.657 -0.652 . . . . 0.0 110.682 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.534 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 83.1 m-70 -105.93 12.58 30.44 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.121 -0.987 . . . . 0.0 110.39 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER 47.42 28.35 1.1 Allowed 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 121.614 0.721 . . . . 0.0 110.895 -179.327 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.497 HG22 ' CB ' ' A' ' 38' ' ' HIS . 8.2 m -130.96 -170.45 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 O-C-N 121.203 -0.936 . . . . 0.0 109.873 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -62.47 -177.27 0.13 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.497 -0.752 . . . . 0.0 109.853 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.487 ' HB3' ' CD1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -146.28 111.17 4.33 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 120.902 -1.124 . . . . 0.0 110.179 -179.524 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -60.15 134.04 53.56 Favored 'Trans proline' 0 C--N 1.316 -1.157 0 C-N-CA 122.115 1.877 . . . . 0.0 110.298 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.644 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 1.2 pp -88.8 9.93 22.83 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.303 -0.873 . . . . 0.0 110.835 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 43.7 p -70.36 -9.93 57.6 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.064 -1.022 . . . . 0.0 110.569 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 ttt -95.77 -22.05 17.75 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.94 -1.1 . . . . 0.0 110.531 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.467 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -67.27 152.02 46.47 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.829 -1.169 . . . . 0.0 110.055 -179.895 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.413 ' HB2' ' OE1' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -106.94 -160.52 0.74 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.379 -0.826 . . . . 0.0 109.716 179.836 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -47.67 -73.2 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.264 -0.897 . . . . 0.0 110.698 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -136.48 -158.52 8.09 Favored Glycine 0 N--CA 1.498 2.778 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.647 HD11 ' O ' ' A' ' 15' ' ' THR . 9.3 mt -50.91 111.15 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.223 -1.163 . . . . 0.0 110.033 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.413 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -78.16 156.45 29.87 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.423 -0.798 . . . . 0.0 109.213 179.612 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -154.99 163.05 40.85 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.137 -0.977 . . . . 0.0 109.718 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.85 -168.77 3.2 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.04 124.88 23.75 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.944 -1.097 . . . . 0.0 108.99 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.5 mtt180 -53.22 136.84 35.72 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.438 -0.789 . . . . 0.0 110.07 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.729 0 O-C-N 121.538 -0.727 . . . . 0.0 109.799 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.828 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.31 -22.57 32.5 Favored Glycine 0 N--CA 1.498 2.806 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 -179.315 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.402 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 26.4 m -66.9 99.87 0.67 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.121 -1.223 . . . . 0.0 109.717 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.8 m -97.82 104.32 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.577 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 42.3 t -40.72 106.88 0.06 Allowed 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.719 -0.613 . . . . 0.0 110.549 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.4 m -57.31 -17.22 11.16 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.554 -0.716 . . . . 0.0 111.595 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.499 ' OD1' HG11 ' A' ' 27' ' ' VAL . 5.3 m120 -95.43 -30.91 13.63 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.654 -1.278 . . . . 0.0 111.419 -179.018 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.493 ' SG ' ' HB ' ' A' ' 12' ' ' THR . 13.3 p -133.15 17.94 4.08 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.557 -1.34 . . . . 0.0 111.06 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 7' ' ' CYS . 26.4 mt-30 44.67 31.78 0.69 Allowed 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.318 -0.863 . . . . 0.0 112.108 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.498 HG22 ' CB ' ' A' ' 7' ' ' CYS . 3.2 t -90.61 127.38 36.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.655 -1.278 . . . . 0.0 109.376 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.21 -20.48 24.13 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.578 -0.701 . . . . 0.0 109.29 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.455 HG21 ' O ' ' A' ' 49' ' ' ASP . 18.7 p -106.79 133.86 50.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.209 -0.932 . . . . 0.0 109.021 179.184 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.552 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 8.0 p -146.06 156.59 43.57 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.219 -0.926 . . . . 0.0 110.502 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.59 HG22 HG21 ' A' ' 51' ' ' ILE . 43.4 p -87.02 -29.59 21.85 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.671 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 24.5 mt -146.33 91.01 2.0 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.282 -0.886 . . . . 0.0 109.289 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.552 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.8 m95 -54.7 102.67 0.07 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.947 -1.095 . . . . 0.0 109.545 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -101.13 95.22 6.41 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.454 -0.779 . . . . 0.0 110.128 -178.935 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.3 mmt180 -62.74 110.29 1.69 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.194 -0.942 . . . . 0.0 108.895 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.6 137.78 83.25 Favored Pre-proline 0 N--CA 1.496 1.862 0 O-C-N 121.195 -0.941 . . . . 0.0 110.182 -179.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -56.39 -29.59 77.92 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 C-N-CA 122.701 2.267 . . . . 0.0 110.832 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 18.9 ttm -54.88 -25.25 27.68 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.577 -0.702 . . . . 0.0 109.483 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.43 30.92 2.94 Favored Glycine 0 N--CA 1.497 2.726 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -140.27 124.34 10.7 Favored Pre-proline 0 N--CA 1.493 1.678 0 O-C-N 121.165 -1.197 . . . . 0.0 110.107 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.542 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.7 Cg_endo -65.94 104.16 0.67 Allowed 'Trans proline' 0 C--N 1.314 -1.275 0 C-N-CA 122.143 1.895 . . . . 0.0 109.805 179.293 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.577 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -117.3 127.27 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-O 122.156 0.979 . . . . 0.0 110.731 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.532 ' SG ' ' HB3' ' A' ' 30' ' ' ALA . 12.0 p -48.97 138.32 11.72 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.726 -0.609 . . . . 0.0 109.594 179.11 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.671 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 1.6 t-20 -44.68 -33.3 1.79 Allowed 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.519 -0.738 . . . . 0.0 110.779 -179.298 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.532 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -54.63 -48.44 72.26 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.088 -1.008 . . . . 0.0 109.584 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.461 ' SG ' ' HD3' ' A' ' 42' ' ' ARG . 26.8 m -64.18 -39.11 93.31 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.434 -0.791 . . . . 0.0 109.382 179.177 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.54 -28.65 72.09 Favored Glycine 0 N--CA 1.496 2.633 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.546 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 42.5 mt -76.91 -70.1 0.48 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.319 -1.107 . . . . 0.0 110.387 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.524 ' HA ' HD13 ' A' ' 37' ' ' LEU . 7.7 t80 -43.83 -35.59 1.99 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.352 -0.843 . . . . 0.0 109.146 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.528 ' O ' ' HA ' ' A' ' 39' ' ' GLN . 28.6 t80 -58.55 -51.92 67.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.481 -0.762 . . . . 0.0 110.527 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.546 ' HD3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -59.59 -22.43 61.76 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.392 -1.442 . . . . 0.0 110.723 -179.534 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.524 HD13 ' HA ' ' A' ' 34' ' ' TYR . 1.9 mp -73.73 -69.32 0.44 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.41 -0.806 . . . . 0.0 110.249 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.549 ' HB2' HG22 ' A' ' 40' ' ' VAL . 29.9 m80 -100.96 15.08 29.8 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.282 -0.886 . . . . 0.0 110.191 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.528 ' HA ' ' O ' ' A' ' 35' ' ' TYR . 4.4 pm0 36.86 43.88 0.32 Allowed 'General case' 0 N--CA 1.503 2.203 0 CA-C-O 121.547 0.689 . . . . 0.0 111.45 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.549 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.2 m -132.92 178.4 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 O-C-N 121.434 -0.792 . . . . 0.0 109.989 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -70.4 172.95 7.49 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.286 -0.883 . . . . 0.0 110.475 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.461 ' HD3' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -131.83 131.73 22.85 Favored Pre-proline 0 N--CA 1.501 2.123 0 O-C-N 121.306 -0.871 . . . . 0.0 109.226 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.574 ' HB2' HG22 ' A' ' 45' ' ' THR . 3.3 Cg_endo -68.44 146.56 68.77 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 122.492 2.128 . . . . 0.0 111.674 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.505 ' O ' ' HB3' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -92.93 -3.24 54.88 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.617 -0.677 . . . . 0.0 110.061 178.754 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.574 HG22 ' HB2' ' A' ' 43' ' ' PRO . 2.2 t -63.69 -35.78 81.67 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.914 -1.116 . . . . 0.0 110.281 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 5.4 ttt -84.38 8.56 15.79 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.99 -1.069 . . . . 0.0 110.076 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.505 ' HB3' ' O ' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -75.08 157.38 34.85 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.859 -1.15 . . . . 0.0 109.907 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -139.33 146.83 40.77 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.247 -0.908 . . . . 0.0 109.232 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ASP . . . . . 0.455 ' O ' HG21 ' A' ' 14' ' ' THR . 0.5 OUTLIER -64.89 -39.15 93.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.859 . . . . 0.0 109.625 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -98.11 130.66 10.31 Favored Glycine 0 N--CA 1.495 2.632 0 N-CA-C 109.026 -1.629 . . . . 0.0 109.026 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.59 HG21 HG22 ' A' ' 16' ' ' THR . 5.3 mt -45.93 113.13 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.664 -0.904 . . . . 0.0 109.921 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -55.17 149.77 11.91 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.689 -0.632 . . . . 0.0 110.309 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.88 160.94 40.59 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.129 -0.982 . . . . 0.0 109.462 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -151.5 -161.64 1.37 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.655 -0.653 . . . . 0.0 109.858 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -55.99 133.66 51.85 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.074 -1.016 . . . . 0.0 108.949 179.27 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -61.32 158.99 13.17 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 121.607 0.718 . . . . 0.0 110.199 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.4 ttmt . . . . . 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 0.0 110.0 179.796 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 121.101 0.477 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 53.42 36.64 53.94 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.449 ' O ' ' CH2' ' A' ' 18' ' ' TRP . 25.2 m -55.45 94.54 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.553 -0.969 . . . . 0.0 109.857 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.4 m -89.95 112.31 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.587 ' HB3' HG22 ' A' ' 12' ' ' THR . 38.7 t -44.18 109.44 0.15 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.498 -0.751 . . . . 0.0 110.669 -178.185 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.7 m -57.73 -20.08 32.12 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.11 -0.994 . . . . 0.0 111.72 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.455 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 9.4 m-20 -85.67 -30.74 22.96 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.951 -1.093 . . . . 0.0 110.786 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.578 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 18.6 p -141.86 24.84 2.0 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.666 -1.271 . . . . 0.0 111.103 179.562 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.512 ' N ' ' O ' ' A' ' 7' ' ' CYS . 2.8 pt20 40.36 26.95 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.786 -0.571 . . . . 0.0 111.936 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.587 HG22 ' HB3' ' A' ' 7' ' ' CYS . 5.7 t -85.65 130.13 34.65 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.779 -1.201 . . . . 0.0 109.531 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -90.66 6.12 45.21 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.533 -0.73 . . . . 0.0 109.292 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.48 ' HB ' ' CG1' ' A' ' 51' ' ' ILE . 14.5 p -125.82 124.55 41.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.259 -0.901 . . . . 0.0 109.57 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.634 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 9.6 p -145.3 146.44 31.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.036 -1.04 . . . . 0.0 110.387 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.427 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 22.5 p -67.04 -38.54 86.07 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.007 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 16' ' ' THR . 11.6 mt -149.86 107.61 3.68 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.634 ' CZ3' HG21 ' A' ' 15' ' ' THR . 40.9 m95 -59.27 94.83 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.515 -0.74 . . . . 0.0 110.262 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.04 87.67 5.42 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.371 -0.83 . . . . 0.0 108.951 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.11 102.8 0.32 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.402 -0.811 . . . . 0.0 109.43 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.1 t -67.59 136.98 93.02 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.351 -0.843 . . . . 0.0 110.169 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -58.98 -30.12 92.45 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 C-N-CA 122.625 2.217 . . . . 0.0 110.924 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -57.67 -24.91 59.15 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.223 -0.923 . . . . 0.0 109.281 179.397 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 113.2 33.9 1.89 Allowed Glycine 0 N--CA 1.496 2.666 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -136.77 109.27 9.25 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.21 -1.171 . . . . 0.0 110.596 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.535 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 5.8 Cg_exo -62.36 102.6 0.28 Allowed 'Trans proline' 0 C--N 1.315 -1.21 0 C-N-CA 122.155 1.903 . . . . 0.0 109.464 178.645 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.458 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -111.69 155.89 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 120.977 -1.077 . . . . 0.0 110.943 -179.345 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.507 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 15.3 p -82.32 139.58 34.06 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -38.04 -44.23 0.79 Allowed 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.762 -0.586 . . . . 0.0 111.413 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.28 -48.62 76.24 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.24 -0.912 . . . . 0.0 111.239 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 3.6 m -56.29 -49.78 73.29 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.265 -0.897 . . . . 0.0 108.663 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.09 -38.46 93.07 Favored Glycine 0 N--CA 1.494 2.554 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 33' ' ' LEU . 44.8 mt -67.72 -67.75 0.44 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.492 -1.005 . . . . 0.0 110.13 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.403 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 89.4 t80 -52.74 -37.36 59.18 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.445 -0.785 . . . . 0.0 109.256 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' A' ' 39' ' ' GLN . 43.3 t80 -60.74 -45.65 93.46 Favored 'General case' 0 C--O 1.2 -1.523 0 O-C-N 121.414 -0.804 . . . . 0.0 108.917 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.39 -29.74 61.86 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.194 -1.566 . . . . 0.0 110.06 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 5.4 mp -64.74 -65.82 0.62 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.945 -1.097 . . . . 0.0 110.122 -179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -94.61 -32.73 13.28 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.228 -0.92 . . . . 0.0 109.977 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.575 ' N ' ' O ' ' A' ' 35' ' ' TYR . 21.7 tt0 72.87 46.09 0.27 Allowed 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 121.734 0.778 . . . . 0.0 110.577 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 m -140.34 167.69 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 121.395 -0.815 . . . . 0.0 109.219 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -85.16 129.88 34.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.065 -1.022 . . . . 0.0 109.036 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -130.17 146.38 61.31 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.188 -0.945 . . . . 0.0 109.882 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.0 144.31 99.48 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 C-N-CA 122.622 2.215 . . . . 0.0 111.314 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.722 HD12 ' HB2' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -78.89 48.01 0.8 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.121 -0.987 . . . . 0.0 110.739 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.5 t -66.31 -12.19 55.15 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.133 -0.98 . . . . 0.0 110.141 178.914 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -103.32 -2.28 27.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.988 -1.07 . . . . 0.0 110.565 179.489 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.722 ' HB2' HD12 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -67.1 157.93 32.4 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.631 -1.293 . . . . 0.0 110.256 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.0 mttt -143.51 -163.84 1.74 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.586 -0.696 . . . . 0.0 109.487 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.53 -74.01 0.3 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.211 -0.931 . . . . 0.0 110.015 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.45 161.74 26.44 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.48 ' CG1' ' HB ' ' A' ' 14' ' ' THR . 7.6 mt -55.32 135.43 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.238 -1.154 . . . . 0.0 110.096 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -69.87 150.02 47.24 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.363 -0.836 . . . . 0.0 109.248 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.63 160.85 40.76 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.112 -0.993 . . . . 0.0 109.763 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -151.21 175.96 11.67 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -63.49 93.05 0.07 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -47.55 130.22 13.86 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.662 -0.649 . . . . 0.0 110.503 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.022 0 O-C-N 121.688 -0.633 . . . . 0.0 110.069 -179.791 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.843 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.46 -35.58 2.89 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.558 HG23 ' HB2' ' A' ' 26' ' ' PRO . 3.5 m -64.68 93.77 0.11 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.282 -1.128 . . . . 0.0 109.094 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.8 m -98.65 137.64 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.641 ' HB2' HG22 ' A' ' 12' ' ' THR . 9.4 t -56.16 117.61 3.92 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.47 -0.769 . . . . 0.0 110.659 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -58.52 -16.28 14.78 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.466 -0.771 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.496 ' OD1' ' HD3' ' A' ' 42' ' ' ARG . 4.5 m-80 -109.42 -24.96 10.77 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.923 -1.111 . . . . 0.0 111.569 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.465 ' HA ' ' HB3' ' A' ' 44' ' ' LEU . 4.8 p -140.23 19.82 2.42 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.491 -1.38 . . . . 0.0 111.466 179.491 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 39.24 34.81 0.13 Allowed 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.554 -0.716 . . . . 0.0 112.841 178.066 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.641 HG22 ' HB2' ' A' ' 7' ' ' CYS . 11.0 t -89.18 132.49 34.82 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.61 -1.306 . . . . 0.0 108.822 178.524 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.74 -25.11 18.34 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.471 -0.768 . . . . 0.0 110.191 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.527 ' HB ' HG13 ' A' ' 51' ' ' ILE . 68.9 p -103.88 114.8 29.32 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.167 -0.958 . . . . 0.0 109.209 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.2 p -130.4 161.55 31.1 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 119.664 -0.814 . . . . 0.0 110.594 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.4 p -82.8 -36.46 25.56 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 17.8 mt -143.05 106.09 4.54 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.55 ' CH2' HG22 ' A' ' 5' ' ' THR . 16.3 m95 -64.27 107.21 1.26 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.373 -0.829 . . . . 0.0 110.391 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.602 ' HB3' HG23 ' A' ' 27' ' ' VAL . 6.8 tpt180 -81.66 72.97 8.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 108.719 179.196 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 10.7 tpp180 -63.52 92.42 0.06 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.0 143.79 91.51 Favored Pre-proline 0 N--CA 1.499 1.979 0 O-C-N 121.338 -0.851 . . . . 0.0 110.354 -178.629 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -54.5 -42.56 66.94 Favored 'Trans proline' 0 C--N 1.32 -0.967 0 C-N-CA 122.632 2.221 . . . . 0.0 111.09 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -21.16 58.58 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.283 -0.886 . . . . 0.0 109.972 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.34 42.13 1.19 Allowed Glycine 0 N--CA 1.497 2.719 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -128.7 92.82 39.28 Favored Pre-proline 0 N--CA 1.493 1.687 0 O-C-N 121.373 -1.075 . . . . 0.0 110.091 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.3 Cg_endo -64.35 95.2 0.21 Allowed 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 122.51 2.14 . . . . 0.0 110.003 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.602 HG23 ' HB3' ' A' ' 19' ' ' ARG . 2.4 m -114.05 123.26 69.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.071 -1.018 . . . . 0.0 110.655 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.41 ' HB3' ' CG2' ' A' ' 12' ' ' THR . 6.5 p -45.63 132.62 8.36 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.27 -0.894 . . . . 0.0 109.947 179.219 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.445 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 6.4 t-20 -37.48 -42.45 0.52 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.61 -0.681 . . . . 0.0 111.825 -178.688 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.78 -46.29 50.58 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.24 -0.913 . . . . 0.0 110.217 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.412 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 33.0 m -66.75 -33.61 76.02 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.327 -0.858 . . . . 0.0 109.352 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.01 -38.61 95.66 Favored Glycine 0 N--CA 1.493 2.468 0 N-CA-C 109.156 -1.577 . . . . 0.0 109.156 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.52 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 95.2 mt -73.09 -58.01 3.62 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.526 -0.985 . . . . 0.0 110.045 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.422 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 29.6 t80 -46.14 -37.34 6.82 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.198 -0.938 . . . . 0.0 109.559 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.508 ' O ' ' N ' ' A' ' 39' ' ' GLN . 18.5 t80 -60.7 -55.42 33.4 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.37 -0.831 . . . . 0.0 110.413 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -57.29 -24.1 52.74 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.575 -1.328 . . . . 0.0 110.802 -179.556 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.475 HD12 ' HG3' ' A' ' 36' ' ' LYS . 5.7 mp -65.3 -67.19 0.46 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.345 -0.847 . . . . 0.0 109.823 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.519 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 66.1 m-70 -97.16 -29.5 13.56 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.295 -0.878 . . . . 0.0 110.395 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.519 ' CG ' ' O ' ' A' ' 38' ' ' HIS . 0.1 OUTLIER 87.4 27.5 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.571 0 CA-C-O 121.609 0.719 . . . . 0.0 110.574 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 m -124.63 -171.0 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.078 -1.014 . . . . 0.0 109.629 179.05 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -58.17 175.64 0.21 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.058 -1.027 . . . . 0.0 109.378 179.3 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.496 ' HD3' ' OD1' ' A' ' 9' ' ' ASN . 1.6 mpt_? -119.8 132.86 23.9 Favored Pre-proline 0 N--CA 1.495 1.804 0 O-C-N 120.909 -1.119 . . . . 0.0 109.805 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -62.8 126.32 17.9 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 C-N-CA 122.39 2.06 . . . . 0.0 110.965 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.465 ' HB3' ' HA ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -94.16 -19.72 20.52 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.422 -0.799 . . . . 0.0 110.123 179.521 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.22 -34.33 70.3 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.218 -0.926 . . . . 0.0 110.423 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -74.74 -29.81 61.29 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.243 -0.911 . . . . 0.0 109.482 179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.505 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -64.16 141.75 58.66 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.365 -0.835 . . . . 0.0 109.34 179.795 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 tttt -104.42 178.27 4.61 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.282 -0.886 . . . . 0.0 110.15 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -74.94 -33.69 61.98 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.338 -0.852 . . . . 0.0 110.265 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -114.09 149.03 18.77 Favored Glycine 0 N--CA 1.497 2.757 0 N-CA-C 109.079 -1.609 . . . . 0.0 109.079 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.527 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.2 mt -46.35 107.77 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.545 -0.974 . . . . 0.0 110.128 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 37.6 mt-30 -52.3 147.59 7.67 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.34 161.75 40.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.49 -1.381 . . . . 0.0 109.984 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.46 -152.37 0.43 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -60.02 114.31 2.77 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.808 -1.182 . . . . 0.0 107.944 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -47.17 133.71 11.59 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.665 -0.647 . . . . 0.0 109.864 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp . . . . . 0 N--CA 1.498 1.937 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.451 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.836 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.79 -30.38 9.84 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.221 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.442 HG22 ' CH2' ' A' ' 18' ' ' TRP . 92.7 m -72.61 89.1 1.29 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.188 -1.183 . . . . 0.0 109.579 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 6' ' ' VAL . 32.7 m -85.61 122.13 38.04 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 53.4 t -56.02 113.9 1.71 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.932 -1.105 . . . . 0.0 110.05 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -60.8 -12.96 12.41 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.366 -0.833 . . . . 0.0 111.24 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -99.13 -31.22 11.86 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.82 -1.175 . . . . 0.0 110.702 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 15.0 p -139.42 24.26 2.48 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.56 -1.338 . . . . 0.0 111.424 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.04 23.9 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.215 -0.928 . . . . 0.0 112.71 178.593 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.462 ' H ' ' HB3' ' A' ' 7' ' ' CYS . 5.5 t -86.83 132.1 33.93 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.373 -1.454 . . . . 0.0 110.236 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.35 -25.62 19.31 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.4 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.6 p -97.39 117.58 31.94 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.326 -0.859 . . . . 0.0 109.374 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.456 HG21 ' CH2' ' A' ' 18' ' ' TRP . 18.0 p -132.43 156.04 47.42 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.157 -0.965 . . . . 0.0 111.004 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.644 HG22 ' CG2' ' A' ' 51' ' ' ILE . 28.6 p -83.22 -40.93 18.99 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.596 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 16.6 mt -139.56 92.36 2.56 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 179.475 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.456 ' CH2' HG21 ' A' ' 15' ' ' THR . 10.5 m95 -57.6 127.97 34.72 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.195 -0.94 . . . . 0.0 110.148 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -116.16 86.07 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.379 -0.826 . . . . 0.0 109.122 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.46 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 12.8 mmm180 -62.63 102.73 0.36 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.371 -0.831 . . . . 0.0 109.314 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.481 ' HB2' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -63.65 143.57 97.95 Favored Pre-proline 0 N--CA 1.498 1.941 0 O-C-N 121.165 -0.959 . . . . 0.0 110.263 -179.292 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -53.99 -44.01 53.11 Favored 'Trans proline' 0 C--N 1.318 -1.03 0 C-N-CA 122.866 2.377 . . . . 0.0 111.26 -179.141 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -22.12 45.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.313 -0.867 . . . . 0.0 109.941 179.376 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.0 38.35 1.41 Allowed Glycine 0 N--CA 1.497 2.759 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 21' ' ' SER . 15.8 m-20 -128.51 98.21 26.13 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.324 -1.104 . . . . 0.0 110.082 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.497 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.9 Cg_endo -64.83 101.5 0.39 Allowed 'Trans proline' 0 C--N 1.311 -1.411 0 C-N-CA 121.956 1.771 . . . . 0.0 109.866 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.49 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -115.01 126.29 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.209 -0.932 . . . . 0.0 110.281 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.453 ' SG ' ' HB3' ' A' ' 30' ' ' ALA . 6.8 p -50.4 135.69 21.69 Favored 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.698 -0.626 . . . . 0.0 109.421 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.596 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t-20 -38.17 -43.81 0.8 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.564 -0.71 . . . . 0.0 111.384 -178.968 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.453 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -48.15 -45.31 33.12 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.525 -0.735 . . . . 0.0 110.359 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 51.3 m -70.3 -35.45 73.71 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.436 -0.79 . . . . 0.0 109.556 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.77 -31.73 81.87 Favored Glycine 0 N--CA 1.496 2.658 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 33' ' ' LEU . 96.8 mt -79.25 -61.22 2.08 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.248 -1.148 . . . . 0.0 110.079 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.578 ' CE2' ' HB2' ' A' ' 42' ' ' ARG . 33.1 t80 -50.79 -36.03 34.94 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.379 -0.826 . . . . 0.0 108.886 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.561 ' O ' ' N ' ' A' ' 39' ' ' GLN . 18.5 t80 -59.45 -53.68 55.34 Favored 'General case' 0 C--O 1.199 -1.559 0 O-C-N 121.54 -0.725 . . . . 0.0 109.669 179.26 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.639 ' HD3' HD12 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -55.02 -27.41 44.19 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 119.918 -1.739 . . . . 0.0 110.267 179.616 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.639 HD12 ' HD3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -66.57 -71.14 0.21 Allowed 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.896 -1.128 . . . . 0.0 109.92 179.614 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.445 ' HB2' HG22 ' A' ' 40' ' ' VAL . 20.5 m80 -96.19 -28.6 14.48 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.204 -0.935 . . . . 0.0 109.56 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.561 ' N ' ' O ' ' A' ' 35' ' ' TYR . 21.5 tt0 73.3 52.43 0.13 Allowed 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 122.163 0.983 . . . . 0.0 110.336 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.3 m -141.34 170.49 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -78.54 126.04 30.2 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.814 -1.179 . . . . 0.0 109.981 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.578 ' HB2' ' CE2' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -102.57 131.86 21.94 Favored Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.037 -1.04 . . . . 0.0 109.77 -179.55 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.759 ' HB2' HG23 ' A' ' 45' ' ' THR . 1.0 OUTLIER -64.51 150.66 87.85 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.283 1.989 . . . . 0.0 110.334 178.967 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.484 ' HB3' ' O ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -84.67 30.77 0.55 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.002 -1.061 . . . . 0.0 110.406 179.699 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 45' ' ' THR . . . . . 0.759 HG23 ' HB2' ' A' ' 43' ' ' PRO . 33.8 p -70.68 -17.14 62.85 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.129 -0.982 . . . . 0.0 109.948 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.56 1.68 51.57 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.987 -1.071 . . . . 0.0 110.428 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.481 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -79.05 166.45 22.3 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 120.807 -1.183 . . . . 0.0 109.706 179.655 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 tptt -134.42 -172.55 3.04 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.36 -0.837 . . . . 0.0 109.469 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -59.85 -50.71 72.72 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.309 -0.869 . . . . 0.0 110.027 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.11 171.77 15.82 Favored Glycine 0 N--CA 1.494 2.501 0 N-CA-C 109.446 -1.462 . . . . 0.0 109.446 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.644 ' CG2' HG22 ' A' ' 16' ' ' THR . 5.3 mt -49.55 125.72 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.488 -1.007 . . . . 0.0 109.995 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.25 154.81 41.36 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.554 -0.716 . . . . 0.0 110.203 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -156.32 154.08 30.04 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.454 ' HG2' ' NH1' ' A' ' 54' ' ' ARG . 0.4 OUTLIER -151.67 -164.94 2.1 Favored 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -65.57 89.74 0.11 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.995 -1.066 . . . . 0.0 108.158 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.77 175.52 1.45 Allowed 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.564 0.697 . . . . 0.0 110.365 -178.903 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.626 -0.671 . . . . 0.0 109.608 179.373 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.737 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.22 -14.77 6.52 Favored Glycine 0 N--CA 1.497 2.729 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 -179.082 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.658 HG23 ' HB2' ' A' ' 26' ' ' PRO . 4.3 m -62.81 89.36 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.085 -1.244 . . . . 0.0 109.631 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 6' ' ' VAL . 35.0 m -82.48 114.27 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.539 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 45.3 t -49.35 110.08 0.33 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.253 -0.904 . . . . 0.0 110.468 -178.701 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.2 m -60.37 -13.22 11.99 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.171 -0.955 . . . . 0.0 111.149 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.519 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 1.0 OUTLIER -92.54 -30.96 15.39 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.822 -1.174 . . . . 0.0 110.69 -179.654 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.519 ' SG ' ' HD2' ' A' ' 47' ' ' ARG . 16.9 p -141.82 24.87 2.0 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.932 -1.105 . . . . 0.0 111.175 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 42.67 27.61 0.1 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.308 -0.87 . . . . 0.0 112.229 179.085 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.509 HG22 ' CB ' ' A' ' 7' ' ' CYS . 6.9 t -89.88 127.49 36.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.657 -1.277 . . . . 0.0 109.975 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -90.71 -12.59 36.19 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.534 -0.729 . . . . 0.0 109.63 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.464 ' HB ' HG13 ' A' ' 51' ' ' ILE . 30.0 p -113.35 126.1 55.0 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.213 -0.93 . . . . 0.0 108.576 179.219 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.561 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 20.3 p -139.96 160.85 38.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.13 -0.981 . . . . 0.0 110.228 -179.238 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.444 HG22 HG21 ' A' ' 51' ' ' ILE . 44.6 p -91.67 -26.1 18.81 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.526 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.696 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 63.4 mt -144.09 87.45 1.9 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 179.506 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.561 ' CZ3' HG21 ' A' ' 15' ' ' THR . 6.0 m95 -57.44 106.72 0.36 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.075 -1.016 . . . . 0.0 110.543 -179.327 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.0 92.39 4.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.328 -0.858 . . . . 0.0 109.559 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.51 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 2.0 tmt_? -72.76 126.53 30.13 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.118 -0.989 . . . . 0.0 109.729 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.0 t -90.17 140.42 27.31 Favored Pre-proline 0 N--CA 1.497 1.906 0 O-C-N 121.334 -0.854 . . . . 0.0 109.782 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -55.89 -36.04 94.97 Favored 'Trans proline' 0 C--N 1.32 -0.944 0 C-N-CA 122.582 2.188 . . . . 0.0 110.908 -179.563 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.4 ttt -51.45 -24.9 5.51 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.517 -0.739 . . . . 0.0 109.833 178.906 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 24' ' ' GLY . . . . . 0.441 ' HA2' ' CZ ' ' A' ' 20' ' ' ARG . . . 111.22 28.51 3.8 Favored Glycine 0 N--CA 1.496 2.673 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 179.892 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -133.48 104.76 12.09 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.21 -1.17 . . . . 0.0 110.419 -179.574 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.658 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.8 Cg_endo -64.0 117.88 4.86 Favored 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.127 1.885 . . . . 0.0 109.66 178.674 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.539 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -127.58 125.24 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.055 -1.028 . . . . 0.0 110.64 -179.625 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.448 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 8.0 p -51.53 131.61 29.49 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 179.261 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.696 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 23.8 t-20 -39.63 -38.5 0.62 Allowed 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.633 -0.667 . . . . 0.0 111.34 -178.931 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.435 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -51.23 -43.27 61.42 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.255 -0.903 . . . . 0.0 110.279 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.519 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 12.5 m -66.92 -44.6 80.31 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.126 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.54 -31.28 77.1 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 179.128 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.445 ' HA ' HD23 ' A' ' 33' ' ' LEU . 48.5 mt -72.83 -67.61 0.55 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.331 -1.1 . . . . 0.0 110.047 -179.564 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 62.4 t80 -49.6 -35.01 19.47 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.399 -0.813 . . . . 0.0 109.638 179.958 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.537 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 13.1 t80 -61.5 -51.45 68.6 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.389 -0.819 . . . . 0.0 109.877 179.439 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -55.02 -26.34 36.5 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.28 -1.512 . . . . 0.0 110.567 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -72.96 -65.16 0.83 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.098 -1.001 . . . . 0.0 110.719 -179.308 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.492 ' HB2' HG22 ' A' ' 40' ' ' VAL . 26.6 m80 -97.76 -27.19 14.44 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.325 -0.859 . . . . 0.0 110.213 -179.471 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.537 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 77.22 31.75 0.48 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-O 121.652 0.739 . . . . 0.0 110.779 179.876 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.6 m -121.33 175.7 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 120.911 -1.118 . . . . 0.0 109.48 178.564 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -60.82 167.92 2.57 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.164 -0.96 . . . . 0.0 110.395 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.463 ' HD3' ' HD2' ' A' ' 43' ' ' PRO . 6.5 tpp180 -135.57 103.9 10.17 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.04 -1.038 . . . . 0.0 109.462 179.907 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.463 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 6.1 Cg_exo -57.26 137.84 83.51 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 C-N-CA 122.095 1.863 . . . . 0.0 110.229 179.657 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.554 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -79.56 6.94 9.22 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.428 -0.795 . . . . 0.0 111.013 -179.608 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.7 p -56.97 -20.32 23.1 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.979 -1.075 . . . . 0.0 110.392 179.252 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -82.55 -10.04 59.15 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.949 -1.095 . . . . 0.0 110.111 179.239 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.554 ' HG3' ' HB2' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -80.42 155.91 26.89 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.88 -1.138 . . . . 0.0 109.651 -179.971 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.433 ' HA ' ' HD2' ' A' ' 48' ' ' LYS . 5.5 mmmt -125.39 -156.86 0.75 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.216 -0.928 . . . . 0.0 109.489 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -51.25 -53.08 38.83 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.174 -0.954 . . . . 0.0 109.719 179.801 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -139.91 -168.32 11.29 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 179.533 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.464 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.1 mt -53.75 125.36 7.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.403 -1.057 . . . . 0.0 110.063 179.92 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -66.32 142.69 57.56 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.409 -0.807 . . . . 0.0 109.427 179.322 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.39 164.22 36.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.991 -1.068 . . . . 0.0 109.771 179.578 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.79 -165.44 2.23 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -179.59 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -54.27 116.27 2.52 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.052 -1.03 . . . . 0.0 108.712 179.107 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -45.05 135.64 5.29 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.585 -0.697 . . . . 0.0 110.607 -178.9 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt . . . . . 0 N--CA 1.497 1.898 0 O-C-N 121.43 -0.793 . . . . 0.0 109.915 -179.987 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 121.373 0.606 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.99 -40.37 2.54 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.239 -1.944 . . . . 0.0 108.239 -178.539 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.531 HG23 ' CB ' ' A' ' 26' ' ' PRO . 54.4 m -80.63 89.21 5.7 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.381 -1.07 . . . . 0.0 109.471 179.043 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.1 m -101.59 131.26 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 33.6 t -47.63 114.98 1.0 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.544 -0.722 . . . . 0.0 111.0 -179.122 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.1 m -59.69 -13.48 10.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.087 -1.008 . . . . 0.0 110.323 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -102.51 -32.06 10.12 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.822 -1.174 . . . . 0.0 110.931 -179.814 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.479 ' HB2' ' HA ' ' A' ' 44' ' ' LEU . 13.0 p -140.63 23.34 2.3 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.602 -1.312 . . . . 0.0 111.581 -179.532 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 38.75 29.45 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.495 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 178.675 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.523 HG23 HG22 ' A' ' 15' ' ' THR . 15.3 t -86.69 132.7 33.8 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.669 -1.269 . . . . 0.0 109.403 178.981 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.4 p -89.31 -28.83 19.6 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.565 -0.709 . . . . 0.0 109.34 179.745 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.402 ' HB ' HG13 ' A' ' 51' ' ' ILE . 23.2 p -90.18 108.36 19.7 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.839 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.743 ' C ' HD11 ' A' ' 51' ' ' ILE . 14.6 p -127.08 144.36 51.05 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.161 -0.962 . . . . 0.0 109.937 -179.527 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 30.9 p -65.96 -36.27 82.87 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.122 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.515 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -149.08 120.31 7.81 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.055 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.571 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.6 m95 -73.6 95.32 2.28 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.454 -0.779 . . . . 0.0 109.808 -179.452 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 77.11 2.3 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.403 -0.811 . . . . 0.0 108.82 179.629 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.5 mmt180 -61.19 95.3 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.454 -0.779 . . . . 0.0 109.059 -179.795 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.2 144.31 94.69 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.394 -0.816 . . . . 0.0 109.967 -179.162 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -58.69 -20.91 53.18 Favored 'Trans proline' 0 C--N 1.32 -0.973 0 C-N-CA 122.47 2.113 . . . . 0.0 110.672 179.85 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.8 0.04 25.31 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.18 -0.95 . . . . 0.0 109.9 178.978 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.66 32.57 15.15 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 109.433 -1.467 . . . . 0.0 109.433 -179.48 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -129.51 96.59 26.93 Favored Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 121.443 -1.034 . . . . 0.0 110.553 -179.232 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.531 ' CB ' HG23 ' A' ' 5' ' ' THR . 2.6 Cg_endo -64.16 111.38 1.58 Allowed 'Trans proline' 0 C--N 1.314 -1.244 0 C-N-CA 122.223 1.949 . . . . 0.0 110.172 178.89 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.494 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -121.45 124.77 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.418 -0.801 . . . . 0.0 110.078 179.896 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.444 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 5.0 p -48.46 135.7 13.76 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.589 -0.694 . . . . 0.0 109.886 179.663 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.515 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 4.6 t-20 -37.04 -44.51 0.53 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.62 -0.675 . . . . 0.0 112.2 -178.608 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.66 -51.92 34.64 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.421 -0.8 . . . . 0.0 110.235 -179.703 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 63.6 m -63.63 -39.54 94.6 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.301 -0.875 . . . . 0.0 109.537 179.665 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.0 -36.13 91.8 Favored Glycine 0 N--CA 1.498 2.806 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 179.663 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.433 ' O ' HD13 ' A' ' 37' ' ' LEU . 85.7 mt -73.21 -66.55 0.67 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.395 -1.062 . . . . 0.0 109.985 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.826 ' HA ' HD22 ' A' ' 37' ' ' LEU . 8.3 t80 -49.11 -40.44 32.18 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.235 -0.916 . . . . 0.0 109.114 179.628 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.465 ' O ' ' N ' ' A' ' 39' ' ' GLN . 38.2 t80 -51.0 -48.63 61.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.633 -0.667 . . . . 0.0 109.405 179.486 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.39 -38.46 87.57 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.065 -1.022 . . . . 0.0 110.248 179.617 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.826 HD22 ' HA ' ' A' ' 34' ' ' TYR . 5.1 mp -41.08 -51.37 3.37 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.507 -0.745 . . . . 0.0 110.197 -179.577 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.664 ' HB2' HG22 ' A' ' 40' ' ' VAL . 4.1 m-70 -127.91 17.73 6.74 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.27 -0.893 . . . . 0.0 109.555 179.298 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.465 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.3 OUTLIER 47.22 46.77 16.66 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.817 0.817 . . . . 0.0 109.597 -178.989 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.664 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.8 m -133.6 164.36 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 O-C-N 121.41 -0.806 . . . . 0.0 109.963 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -77.97 163.06 26.3 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.431 -0.793 . . . . 0.0 110.351 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.614 ' HB2' ' CD1' ' A' ' 34' ' ' TYR . 4.4 tpt180 -130.14 121.02 19.44 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.222 -0.924 . . . . 0.0 109.222 179.289 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.02 147.0 91.82 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 C-N-CA 121.925 1.75 . . . . 0.0 110.432 179.807 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.479 ' HA ' ' HB2' ' A' ' 10' ' ' CYS . 1.7 pt? -63.08 -10.99 16.62 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.442 -0.786 . . . . 0.0 110.921 179.588 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.9 t -48.73 -31.07 6.32 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.208 -0.933 . . . . 0.0 110.824 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.3 ttt -80.68 -39.66 26.83 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.162 -0.961 . . . . 0.0 109.426 179.656 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.486 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.8 OUTLIER -61.8 129.21 39.92 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.111 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.16 -149.56 0.36 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.281 -0.887 . . . . 0.0 109.685 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -50.63 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.433 -0.792 . . . . 0.0 110.899 -179.182 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.02 -168.45 13.1 Favored Glycine 0 N--CA 1.495 2.587 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 -179.752 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.743 HD11 ' C ' ' A' ' 15' ' ' THR . 13.9 mt -48.05 129.53 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.606 -0.938 . . . . 0.0 110.455 -179.772 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -76.36 78.68 3.11 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.3 -0.875 . . . . 0.0 109.861 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.47 161.15 26.25 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.401 -0.812 . . . . 0.0 109.638 179.591 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.427 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.4 OUTLIER -150.77 -153.63 0.5 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.61 -0.681 . . . . 0.0 109.767 -179.501 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -74.97 128.94 36.75 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.06 -1.025 . . . . 0.0 108.724 179.031 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.59 133.64 10.1 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.586 -0.696 . . . . 0.0 110.643 -179.349 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt . . . . . 0 N--CA 1.497 1.883 0 O-C-N 121.366 -0.834 . . . . 0.0 109.497 179.801 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.53 -33.54 3.58 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 -179.058 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.594 HG23 ' HB2' ' A' ' 26' ' ' PRO . 27.2 m -62.77 90.75 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.32 -1.106 . . . . 0.0 108.787 178.95 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 6' ' ' VAL . 9.5 m -84.96 112.66 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.069 -1.019 . . . . 0.0 108.379 -179.975 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.505 ' O ' ' N ' ' A' ' 11' ' ' GLN . 44.8 t -47.45 113.7 0.74 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.428 -0.795 . . . . 0.0 109.917 -179.157 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 62.0 m -66.68 -12.56 58.86 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.021 -1.049 . . . . 0.0 111.001 -179.247 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.432 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 6.4 m-20 -89.62 -31.31 17.61 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.84 -1.162 . . . . 0.0 110.228 179.879 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.47 ' SG ' HG22 ' A' ' 12' ' ' THR . 16.8 p -140.46 17.4 2.38 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.887 -1.133 . . . . 0.0 111.057 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 7' ' ' CYS . 11.5 mt-30 51.49 21.2 1.19 Allowed 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.989 -1.069 . . . . 0.0 111.801 178.949 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.47 HG22 ' SG ' ' A' ' 10' ' ' CYS . 6.3 t -87.61 136.47 32.93 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.681 -1.262 . . . . 0.0 110.564 -179.724 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -27.12 18.93 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.302 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.517 HG21 ' HA2' ' A' ' 50' ' ' GLY . 18.6 p -90.06 127.09 35.99 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.416 -0.802 . . . . 0.0 109.537 179.527 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.696 HG21 ' CH2' ' A' ' 18' ' ' TRP . 10.3 p -145.69 144.09 30.18 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.409 -0.807 . . . . 0.0 110.225 -179.558 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.552 HG22 HG23 ' A' ' 51' ' ' ILE . 20.2 p -72.63 -28.59 62.85 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.329 -0.857 . . . . 0.0 109.098 179.139 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.587 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -152.71 117.17 4.98 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.173 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.696 ' CH2' HG21 ' A' ' 15' ' ' THR . 8.0 m95 -73.82 108.81 6.87 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.183 -0.948 . . . . 0.0 110.09 -179.02 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -99.3 94.47 6.48 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.133 -0.979 . . . . 0.0 109.452 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.436 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.3 tpp180 -66.6 102.71 0.95 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 108.364 179.364 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -56.36 146.74 51.62 Favored Pre-proline 0 N--CA 1.5 2.052 0 O-C-N 121.388 -0.82 . . . . 0.0 110.209 -178.718 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -52.92 -43.91 52.82 Favored 'Trans proline' 0 C--N 1.319 -0.995 0 C-N-CA 122.702 2.268 . . . . 0.0 111.07 -179.05 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.6 ttp -57.59 -23.49 51.11 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.414 -0.804 . . . . 0.0 109.717 179.137 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.35 38.22 1.38 Allowed Glycine 0 N--CA 1.496 2.665 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' A' ' 21' ' ' SER . 60.5 m-20 -128.3 110.09 19.54 Favored Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.1 -1.236 . . . . 0.0 110.491 -179.841 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.594 ' HB2' HG23 ' A' ' 5' ' ' THR . 3.5 Cg_exo -62.92 109.86 1.01 Allowed 'Trans proline' 0 C--N 1.313 -1.313 0 C-N-CA 122.011 1.807 . . . . 0.0 110.062 178.627 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.417 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.1 m -121.56 131.38 73.21 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.163 -0.961 . . . . 0.0 110.407 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.471 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.8 p -55.03 132.55 47.4 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.663 -0.648 . . . . 0.0 109.305 179.556 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.587 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 16.7 t-20 -35.58 -46.09 0.39 Allowed 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.87 -0.519 . . . . 0.0 112.162 -178.313 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.77 -45.46 59.0 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.347 -0.845 . . . . 0.0 110.206 -179.688 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.432 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 19.4 m -65.53 -39.34 91.68 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.177 -0.952 . . . . 0.0 109.001 179.263 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.22 -43.39 95.45 Favored Glycine 0 N--CA 1.497 2.743 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.446 ' O ' HD13 ' A' ' 37' ' ' LEU . 46.6 mt -75.69 -57.46 3.87 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.454 -1.027 . . . . 0.0 109.698 -179.831 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.631 ' HA ' HD22 ' A' ' 37' ' ' LEU . 26.9 t80 -51.84 -38.56 56.39 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.512 -0.742 . . . . 0.0 109.046 179.475 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.478 ' O ' ' N ' ' A' ' 39' ' ' GLN . 44.8 t80 -56.35 -45.56 80.38 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 178.705 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.04 -39.4 93.29 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.066 -1.021 . . . . 0.0 109.899 179.319 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.631 HD22 ' HA ' ' A' ' 34' ' ' TYR . 5.8 mp -44.88 -59.12 2.71 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.562 -0.711 . . . . 0.0 110.128 -179.466 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.527 ' CB ' HG22 ' A' ' 40' ' ' VAL . 87.9 m-70 -104.14 4.64 34.34 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.45 -0.781 . . . . 0.0 109.415 178.828 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 49.7 33.83 6.62 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.565 -0.709 . . . . 0.0 110.027 -178.702 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.527 HG22 ' CB ' ' A' ' 38' ' ' HIS . 11.1 m -140.17 163.79 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 O-C-N 121.463 -0.773 . . . . 0.0 110.018 -179.612 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -82.17 140.97 33.44 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.335 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.551 ' HG3' ' CE2' ' A' ' 34' ' ' TYR . 2.3 mmm180 -127.99 150.39 73.5 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.014 -1.054 . . . . 0.0 110.09 -179.493 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -57.09 151.68 49.07 Favored 'Trans proline' 0 C--N 1.315 -1.211 0 C-N-CA 123.005 2.47 . . . . 0.0 111.814 -179.074 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.443 ' HB2' ' HD3' ' A' ' 47' ' ' ARG . 1.0 OUTLIER -71.57 10.18 0.7 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.594 -0.691 . . . . 0.0 111.568 179.793 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.02 -32.41 61.82 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.611 -1.305 . . . . 0.0 110.18 179.54 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.07 -12.78 49.24 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.399 -0.813 . . . . 0.0 110.346 179.515 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.443 ' HD3' ' HB2' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -58.71 162.11 4.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.903 -1.123 . . . . 0.0 109.965 179.822 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.28 149.76 46.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.458 -0.776 . . . . 0.0 109.456 178.895 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -63.81 -35.01 79.21 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.493 -0.754 . . . . 0.0 110.175 -179.862 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' GLY . . . . . 0.517 ' HA2' HG21 ' A' ' 14' ' ' THR . . . -134.53 157.0 22.73 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 179.318 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.552 HG23 HG22 ' A' ' 16' ' ' THR . 4.9 mt -53.31 119.5 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.157 -1.202 . . . . 0.0 109.987 -179.618 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.484 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -75.6 167.28 22.19 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.634 -0.666 . . . . 0.0 109.206 179.755 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.484 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -154.98 160.67 41.27 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.571 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.47 -161.66 1.39 Allowed 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -179.617 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.37 94.46 0.06 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.825 -1.172 . . . . 0.0 108.924 179.302 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -54.49 143.84 22.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.483 -0.761 . . . . 0.0 109.97 -179.502 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp . . . . . 0 N--CA 1.493 1.716 0 O-C-N 121.358 -0.839 . . . . 0.0 109.152 179.797 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.239 0.542 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.91 -18.23 12.68 Favored Glycine 0 N--CA 1.495 2.596 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.549 ' O ' HG22 ' A' ' 5' ' ' THR . 15.2 m -76.46 85.57 3.19 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.82 -1.4 . . . . 0.0 110.314 -179.789 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 m -85.77 120.37 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 178.18 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 51.5 t -45.46 111.55 0.35 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.206 -0.934 . . . . 0.0 110.202 -178.327 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 71.8 m -59.71 -14.31 13.64 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.171 -0.956 . . . . 0.0 111.437 -179.212 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.541 ' OD1' ' HD2' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -95.39 -30.83 13.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.634 -1.291 . . . . 0.0 110.734 -179.572 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.486 ' SG ' ' HD3' ' A' ' 47' ' ' ARG . 18.4 p -141.26 28.37 1.87 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.897 -1.127 . . . . 0.0 110.492 179.289 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.46 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 34.22 30.19 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.728 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 179.781 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.453 ' H ' ' HB3' ' A' ' 7' ' ' CYS . 5.1 t -90.88 132.56 35.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.747 -1.22 . . . . 0.0 109.844 179.479 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.2 p -90.29 -28.6 18.67 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.237 -0.914 . . . . 0.0 109.107 179.379 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.7 p -89.86 111.04 21.95 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.431 -0.793 . . . . 0.0 109.479 179.5 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.549 HG21 ' CH2' ' A' ' 18' ' ' TRP . 9.5 p -130.97 166.52 20.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.332 -0.855 . . . . 0.0 110.205 -179.712 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.496 HG22 HG21 ' A' ' 51' ' ' ILE . 16.2 p -89.41 -40.57 12.63 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.353 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 14.3 mt -141.89 112.56 7.22 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.321 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.549 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.0 m95 -69.67 88.72 0.53 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.304 -0.873 . . . . 0.0 109.608 -179.389 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.78 84.85 7.2 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.61 -0.682 . . . . 0.0 109.424 -179.913 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 9.3 tpp180 -62.17 120.83 11.67 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.113 -0.992 . . . . 0.0 109.213 179.726 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.59 144.01 68.84 Favored Pre-proline 0 N--CA 1.498 1.932 0 O-C-N 121.298 -0.876 . . . . 0.0 110.187 -179.439 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -56.45 -42.49 65.09 Favored 'Trans proline' 0 C--N 1.319 -1.014 0 C-N-CA 122.737 2.291 . . . . 0.0 111.197 -179.294 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -21.03 39.62 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.299 -0.875 . . . . 0.0 110.061 179.486 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.63 35.92 1.65 Allowed Glycine 0 N--CA 1.497 2.759 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -127.03 102.75 24.13 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.207 -1.172 . . . . 0.0 110.142 -179.796 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.494 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.6 Cg_endo -64.02 98.56 0.26 Allowed 'Trans proline' 0 C--N 1.312 -1.364 0 C-N-CA 122.162 1.908 . . . . 0.0 109.604 178.793 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.474 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.0 m -109.74 153.94 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 CA-C-O 122.348 1.07 . . . . 0.0 111.114 -179.622 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.467 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 15.3 p -81.48 138.72 35.47 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.433 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 4.7 t-20 -37.96 -37.24 0.24 Allowed 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.695 -0.628 . . . . 0.0 111.971 -178.799 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.39 -42.77 95.94 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.09 -1.006 . . . . 0.0 111.695 -179.329 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.508 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 4.9 m -61.52 -40.67 95.47 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.212 -0.93 . . . . 0.0 109.088 -179.934 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.4 -49.02 54.53 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.427 ' O ' HD13 ' A' ' 37' ' ' LEU . 94.8 mt -60.58 -58.41 8.6 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.638 -0.919 . . . . 0.0 109.63 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.624 ' CE1' ' HD2' ' A' ' 43' ' ' PRO . 20.4 t80 -54.51 -43.84 72.21 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.543 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.507 ' CD2' ' O ' ' A' ' 40' ' ' VAL . 20.0 t80 -51.91 -46.57 64.66 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.508 -0.745 . . . . 0.0 109.073 179.27 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -63.34 -41.92 98.9 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.214 -0.929 . . . . 0.0 110.152 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.568 HD22 ' HA ' ' A' ' 34' ' ' TYR . 3.9 mp -45.36 -59.28 2.76 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.329 -0.857 . . . . 0.0 110.427 -179.439 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.516 ' CB ' HG22 ' A' ' 40' ' ' VAL . 53.4 m-70 -102.61 6.42 39.71 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.374 -0.829 . . . . 0.0 109.853 179.565 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.448 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.6 OUTLIER 46.7 31.89 1.55 Allowed 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.51 -0.744 . . . . 0.0 110.299 -179.212 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.516 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.9 m -134.61 -161.47 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 O-C-N 121.476 -0.765 . . . . 0.0 109.048 179.652 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -59.1 -175.01 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.996 -1.065 . . . . 0.0 110.596 -179.883 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.541 ' HD2' ' OD1' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -141.1 102.91 6.17 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.106 -0.996 . . . . 0.0 109.969 -179.189 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.624 ' HD2' ' CE1' ' A' ' 34' ' ' TYR . 3.9 Cg_exo -60.62 126.05 18.87 Favored 'Trans proline' 0 C--N 1.315 -1.186 0 C-N-CA 121.991 1.794 . . . . 0.0 110.08 179.753 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.429 ' O ' HD12 ' A' ' 44' ' ' LEU . 1.3 pp -85.05 16.43 3.47 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.385 -0.822 . . . . 0.0 110.935 -179.836 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 p -68.45 -5.65 20.46 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.02 -1.05 . . . . 0.0 111.07 -179.917 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.9 mtp -94.23 -26.79 16.49 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.883 -1.136 . . . . 0.0 110.144 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.486 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -65.25 154.4 38.25 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.215 -0.928 . . . . 0.0 110.264 179.994 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.36 -158.61 0.9 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.921 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.08 -39.1 84.9 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.288 -0.882 . . . . 0.0 109.693 179.384 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.07 -175.33 14.13 Favored Glycine 0 N--CA 1.5 2.931 0 N-CA-C 110.19 -1.164 . . . . 0.0 110.19 179.513 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.496 HG21 HG22 ' A' ' 16' ' ' THR . 3.8 mt -62.31 137.12 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.286 -1.126 . . . . 0.0 108.965 179.453 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -65.66 79.87 0.07 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.22 -0.925 . . . . 0.0 111.047 -178.638 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.06 159.54 15.43 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.137 -0.977 . . . . 0.0 110.4 179.564 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.64 -159.11 0.99 Allowed 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -52.56 103.15 0.06 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.833 -1.167 . . . . 0.0 109.159 179.208 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.5 ttm180 -50.74 140.8 14.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.369 -0.832 . . . . 0.0 110.339 -178.834 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.475 -0.766 . . . . 0.0 109.281 179.077 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.79 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.25 -26.52 5.51 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.399 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.478 HG23 ' CB ' ' A' ' 26' ' ' PRO . 70.8 m -68.4 92.64 0.44 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.302 -1.117 . . . . 0.0 109.089 179.295 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -90.91 138.26 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.283 -0.886 . . . . 0.0 108.722 179.839 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.748 ' HB2' HG22 ' A' ' 12' ' ' THR . 24.6 t -62.42 118.08 7.02 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.146 -0.971 . . . . 0.0 110.973 -179.35 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 m -60.4 -15.47 26.52 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.387 -0.821 . . . . 0.0 110.295 178.85 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.673 ' OD1' HG11 ' A' ' 27' ' ' VAL . 9.0 m120 -102.82 -30.4 10.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.065 -1.022 . . . . 0.0 110.852 -179.764 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.493 ' SG ' ' HG3' ' A' ' 47' ' ' ARG . 12.8 p -142.66 23.43 1.94 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.672 -1.268 . . . . 0.0 111.909 -179.306 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 38.25 37.5 0.16 Allowed 'General case' 0 N--CA 1.511 2.597 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 178.483 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.748 HG22 ' HB2' ' A' ' 7' ' ' CYS . 5.3 t -88.14 135.13 33.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.527 -1.358 . . . . 0.0 108.694 178.333 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.4 p -90.44 -10.79 42.45 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.159 -0.963 . . . . 0.0 109.736 179.922 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.422 ' HB ' HG13 ' A' ' 51' ' ' ILE . 34.7 p -121.26 132.53 54.86 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.217 -0.927 . . . . 0.0 108.697 178.926 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 6.5 p -145.74 157.18 43.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.411 -0.806 . . . . 0.0 109.668 -179.811 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.4 p -77.93 -35.63 50.24 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.281 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.522 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.6 mt -146.53 106.58 4.0 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.599 -0.688 . . . . 0.0 109.486 179.638 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.43 ' CH2' HG22 ' A' ' 5' ' ' THR . 13.6 m95 -65.3 111.69 3.13 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.555 -0.715 . . . . 0.0 110.497 -179.372 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.29 72.07 5.3 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.242 -0.911 . . . . 0.0 109.126 179.276 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.51 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.9 OUTLIER -61.98 110.49 1.58 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.204 -0.935 . . . . 0.0 109.277 -179.965 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 21' ' ' SER . . . . . 0.421 ' OG ' ' HD2' ' A' ' 22' ' ' PRO . 0.1 OUTLIER -75.2 154.2 86.3 Favored Pre-proline 0 N--CA 1.497 1.905 0 O-C-N 121.298 -0.876 . . . . 0.0 110.036 -179.705 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 22' ' ' PRO . . . . . 0.421 ' HD2' ' OG ' ' A' ' 21' ' ' SER . 4.7 Cg_exo -53.39 -48.14 23.57 Favored 'Trans proline' 0 C--N 1.319 -1.017 0 C-N-CA 122.762 2.308 . . . . 0.0 111.407 -178.943 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.0 -21.58 59.21 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.341 -0.849 . . . . 0.0 110.05 179.503 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.44 50.59 0.65 Allowed Glycine 0 N--CA 1.496 2.689 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 -179.81 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -127.46 89.58 50.91 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.574 -0.956 . . . . 0.0 109.994 -179.377 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.51 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 1.4 Cg_endo -66.4 94.51 0.31 Allowed 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 122.299 1.999 . . . . 0.0 110.0 179.434 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.673 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.4 m -109.69 125.86 66.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.06 -1.025 . . . . 0.0 110.52 -179.833 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.563 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 5.2 p -49.98 134.26 21.69 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.674 -0.641 . . . . 0.0 110.07 179.786 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.522 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 1.7 t-20 -36.77 -47.74 0.69 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.876 -0.515 . . . . 0.0 111.519 -178.952 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.39 -46.2 25.86 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.43 -0.794 . . . . 0.0 110.578 -179.66 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 27.0 m -66.34 -43.8 85.08 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.21 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.51 -32.17 68.27 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 110.114 -1.194 . . . . 0.0 110.114 179.069 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 33' ' ' LEU . 61.0 mt -79.53 -62.29 1.74 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.334 -1.098 . . . . 0.0 109.844 179.905 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -50.99 -36.73 40.72 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.292 -0.88 . . . . 0.0 108.79 179.346 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.512 ' O ' ' N ' ' A' ' 39' ' ' GLN . 31.0 t80 -61.88 -46.49 89.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.45 -0.781 . . . . 0.0 109.712 179.298 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -22.03 57.96 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.259 -1.525 . . . . 0.0 110.079 179.457 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.1 mp -74.54 -71.82 0.32 Allowed 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.976 -1.078 . . . . 0.0 109.851 179.836 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.452 ' HB2' HG22 ' A' ' 40' ' ' VAL . 51.7 m-70 -93.95 -18.81 21.53 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.309 -0.869 . . . . 0.0 110.477 -179.901 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.512 ' N ' ' O ' ' A' ' 35' ' ' TYR . 2.3 tt0 61.54 53.36 3.36 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-O 122.192 0.996 . . . . 0.0 109.951 -179.897 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.452 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.6 m -138.51 168.08 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.185 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.403 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 9.7 p-10 -70.24 126.15 28.83 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.813 -1.179 . . . . 0.0 109.337 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.414 ' CD ' ' HD2' ' A' ' 43' ' ' PRO . 5.4 tpt180 -96.62 110.53 53.53 Favored Pre-proline 0 N--CA 1.493 1.706 0 O-C-N 121.205 -0.934 . . . . 0.0 109.735 -179.444 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.414 ' HD2' ' CD ' ' A' ' 42' ' ' ARG . 6.2 Cg_exo -56.15 147.21 66.63 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 C-N-CA 121.976 1.784 . . . . 0.0 110.408 179.272 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.406 ' HB2' ' HD2' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -71.27 7.73 1.22 Allowed 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.429 -0.794 . . . . 0.0 111.615 -179.795 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -50.25 -30.68 12.26 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.905 -1.122 . . . . 0.0 109.933 179.232 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.0 ttp -103.56 -24.13 13.44 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.342 -0.849 . . . . 0.0 110.227 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.496 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -59.22 143.52 48.81 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.152 -0.967 . . . . 0.0 109.92 -179.858 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HB2' ' OE1' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -123.39 157.21 33.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.261 -0.899 . . . . 0.0 109.709 179.587 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -71.37 -29.71 65.28 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.599 -0.688 . . . . 0.0 110.323 -179.596 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -111.71 132.6 10.95 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 179.548 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.422 HG13 ' HB ' ' A' ' 14' ' ' THR . 4.9 mt -51.04 125.11 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.724 -0.868 . . . . 0.0 110.63 -179.783 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.465 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -73.72 157.17 37.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.609 -0.682 . . . . 0.0 109.61 179.24 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.06 164.15 38.25 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.01 -1.056 . . . . 0.0 109.825 179.201 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.92 -158.79 0.95 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.587 -0.696 . . . . 0.0 109.383 -179.677 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -55.83 98.47 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.899 -1.126 . . . . 0.0 108.961 179.215 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -49.99 139.74 13.38 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.499 -0.751 . . . . 0.0 110.818 -178.602 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 O-C-N 121.584 -0.698 . . . . 0.0 109.432 179.455 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.95 -11.23 6.96 Favored Glycine 0 N--CA 1.497 2.726 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 -179.192 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.46 HG22 ' CH2' ' A' ' 18' ' ' TRP . 93.9 m -65.45 88.53 0.09 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.071 -1.253 . . . . 0.0 109.626 179.702 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 6' ' ' VAL . 24.9 m -88.53 112.08 23.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 179.16 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.551 ' CB ' HG22 ' A' ' 12' ' ' THR . 52.7 t -46.88 113.36 0.65 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.277 -0.889 . . . . 0.0 110.071 -178.486 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.1 m -61.17 -14.81 27.82 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.359 -0.838 . . . . 0.0 111.073 -179.484 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.427 ' CB ' ' SG ' ' A' ' 31' ' ' CYS . 12.1 m-20 -94.76 -30.09 14.43 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.863 -1.148 . . . . 0.0 110.988 -179.485 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.596 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 18.5 p -139.66 19.84 2.52 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.56 -1.338 . . . . 0.0 111.383 179.598 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 7' ' ' CYS . 3.9 mt-30 45.81 26.17 0.35 Allowed 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.233 -0.917 . . . . 0.0 111.97 179.014 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.551 HG22 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -84.94 136.7 33.51 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.709 -1.244 . . . . 0.0 109.977 179.684 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 p -93.48 1.54 56.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.565 -0.71 . . . . 0.0 109.427 178.89 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.466 ' HB ' HG13 ' A' ' 51' ' ' ILE . 79.2 p -127.42 130.9 50.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.047 -1.033 . . . . 0.0 110.111 -179.606 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.699 ' C ' HD11 ' A' ' 51' ' ' ILE . 9.3 p -147.89 143.03 27.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.443 -0.786 . . . . 0.0 109.771 179.625 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.509 HG22 ' CG2' ' A' ' 51' ' ' ILE . 44.6 p -72.12 -33.57 67.91 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 178.791 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 69.3 mt -142.39 105.54 4.59 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.067 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.603 ' CZ3' HG21 ' A' ' 15' ' ' THR . 12.5 m95 -64.77 86.34 0.05 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.418 -0.802 . . . . 0.0 109.656 -179.877 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.33 81.39 0.37 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 109.73 -179.795 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HD3' ' CA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.96 101.45 0.21 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.073 -1.017 . . . . 0.0 108.766 179.517 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.93 141.72 47.45 Favored Pre-proline 0 N--CA 1.497 1.894 0 O-C-N 121.411 -0.806 . . . . 0.0 109.997 -179.034 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -53.88 -36.21 82.44 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 122.504 2.136 . . . . 0.0 110.962 -179.318 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 23' ' ' MET . . . . . 0.45 ' HA ' ' CE ' ' A' ' 23' ' ' MET . 1.1 tpt -60.03 -22.21 62.35 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.365 -0.834 . . . . 0.0 109.871 179.318 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.92 33.25 2.05 Favored Glycine 0 N--CA 1.497 2.722 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.659 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -126.09 113.0 24.07 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.172 -1.193 . . . . 0.0 110.42 -179.557 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.473 ' CA ' ' HD3' ' A' ' 20' ' ' ARG . 3.2 Cg_exo -64.1 100.1 0.3 Allowed 'Trans proline' 0 C--N 1.316 -1.174 0 C-N-CA 122.313 2.009 . . . . 0.0 110.083 178.879 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.5 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -119.88 127.17 75.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.126 -0.984 . . . . 0.0 110.149 179.947 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.478 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 8.3 p -51.43 136.54 25.44 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.479 -0.763 . . . . 0.0 109.397 179.331 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -43.36 -43.42 5.08 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.418 -0.801 . . . . 0.0 111.611 -178.252 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.34 -44.38 34.27 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.255 -0.903 . . . . 0.0 110.287 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.427 ' SG ' ' CB ' ' A' ' 9' ' ' ASN . 5.4 m -63.69 -43.67 95.94 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.342 -0.849 . . . . 0.0 109.229 179.235 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.4 -57.18 15.97 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 110.35 -1.1 . . . . 0.0 110.35 -179.859 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.9 mt -60.77 -55.79 28.97 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.452 -1.028 . . . . 0.0 109.357 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.454 ' OH ' ' HG3' ' A' ' 42' ' ' ARG . 75.0 t80 -49.95 -43.88 50.23 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.613 -0.68 . . . . 0.0 109.597 179.498 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -56.17 -45.93 79.53 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.301 -0.874 . . . . 0.0 109.285 179.388 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.36 -30.94 71.54 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.095 -1.003 . . . . 0.0 110.142 179.435 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 34' ' ' TYR . 4.7 mp -61.73 -65.62 0.66 Allowed 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.098 -1.001 . . . . 0.0 110.625 -179.608 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.829 ' O ' HG22 ' A' ' 40' ' ' VAL . 59.8 m-70 -95.59 9.32 40.61 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.221 -0.924 . . . . 0.0 110.532 -179.66 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER 41.08 32.51 0.18 Allowed 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.519 -0.738 . . . . 0.0 111.424 -179.182 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.829 HG22 ' O ' ' A' ' 38' ' ' HIS . 4.5 m -145.57 169.77 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 121.281 -0.887 . . . . 0.0 109.807 179.759 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -85.85 154.23 21.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.262 -0.898 . . . . 0.0 109.368 178.899 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.454 ' HG3' ' OH ' ' A' ' 34' ' ' TYR . 30.0 mmt180 -149.98 151.18 31.69 Favored Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 121.061 -1.024 . . . . 0.0 109.77 179.519 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -59.33 147.51 90.7 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 C-N-CA 122.205 1.936 . . . . 0.0 110.785 179.961 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.596 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -89.73 37.64 0.88 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.123 -0.986 . . . . 0.0 110.806 -179.781 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.0 p -70.59 -11.28 60.84 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.011 -1.055 . . . . 0.0 109.971 178.894 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 1.4 tmm? -88.1 -18.55 28.6 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.236 -0.915 . . . . 0.0 110.445 179.64 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.489 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -57.24 139.01 53.98 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.89 -1.131 . . . . 0.0 110.036 -179.889 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -99.49 -177.57 3.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.387 -0.821 . . . . 0.0 109.493 -179.981 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -64.04 -37.5 87.66 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.253 -0.904 . . . . 0.0 110.032 -179.811 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -142.8 171.21 24.92 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.637 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.699 HD11 ' C ' ' A' ' 15' ' ' THR . 14.5 mt -54.44 121.87 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.381 -1.07 . . . . 0.0 109.861 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.35 146.83 52.9 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.39 -0.819 . . . . 0.0 108.822 179.182 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.38 157.59 41.5 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.297 -0.877 . . . . 0.0 109.763 179.278 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.426 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -152.44 -168.71 3.13 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 -179.904 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -61.8 105.5 0.56 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.885 -1.134 . . . . 0.0 108.279 179.012 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -45.25 135.37 5.86 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.286 -0.884 . . . . 0.0 110.048 -178.583 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.511 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.814 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 109.03 -30.34 8.77 Favored Glycine 0 N--CA 1.498 2.825 0 N-CA-C 109.531 -1.427 . . . . 0.0 109.531 -179.348 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.726 HG23 ' HB2' ' A' ' 26' ' ' PRO . 16.2 m -78.62 90.24 4.55 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.128 -1.219 . . . . 0.0 109.579 179.654 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 6' ' ' VAL . 27.9 m -81.93 116.13 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 179.175 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.467 ' CB ' HG22 ' A' ' 12' ' ' THR . 41.3 t -49.1 113.87 0.89 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.203 -0.935 . . . . 0.0 110.11 -178.61 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -60.11 -15.29 22.23 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.635 -0.666 . . . . 0.0 111.141 -179.497 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.417 ' OD1' HG11 ' A' ' 27' ' ' VAL . 5.8 m-20 -96.69 -30.64 13.11 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.911 -1.118 . . . . 0.0 111.376 -179.051 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.542 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 15.6 p -140.49 26.16 2.16 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.698 -1.251 . . . . 0.0 111.189 179.939 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 40.56 27.88 0.04 OUTLIER 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.161 -0.962 . . . . 0.0 112.627 178.422 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.467 HG22 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -89.59 136.78 32.83 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.569 -1.332 . . . . 0.0 110.081 179.925 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.0 p -92.22 -30.42 15.92 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.493 -0.754 . . . . 0.0 109.033 179.168 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.5 p -92.45 125.32 37.05 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.364 -0.835 . . . . 0.0 109.601 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.598 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 16.4 p -143.3 148.94 37.12 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.165 -0.96 . . . . 0.0 110.814 179.961 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.552 HG22 HG21 ' A' ' 51' ' ' ILE . 70.6 p -73.87 -33.92 64.25 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.956 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.497 ' HA ' HD23 ' A' ' 17' ' ' LEU . 15.6 mt -150.87 105.45 3.27 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.405 -0.81 . . . . 0.0 108.92 179.536 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.598 ' CZ3' HG21 ' A' ' 15' ' ' THR . 7.0 m95 -63.49 84.22 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.421 -0.799 . . . . 0.0 110.936 -178.856 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.452 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.3 OUTLIER -80.43 77.51 7.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.08 -1.012 . . . . 0.0 109.194 179.36 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.559 ' CB ' ' HA ' ' A' ' 26' ' ' PRO . 5.2 ppt_? -80.0 138.62 37.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.022 -1.049 . . . . 0.0 110.033 -179.56 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -86.89 148.27 45.2 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.255 -0.903 . . . . 0.0 109.944 -179.802 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -55.0 -31.3 73.85 Favored 'Trans proline' 0 C--N 1.319 -1.026 0 C-N-CA 122.522 2.148 . . . . 0.0 111.024 -179.7 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.04 -28.56 53.12 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.409 -0.807 . . . . 0.0 109.803 179.195 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 117.09 34.52 1.22 Allowed Glycine 0 N--CA 1.497 2.713 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 179.678 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -130.88 96.03 24.02 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.281 -1.129 . . . . 0.0 109.911 -179.794 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.726 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.3 Cg_endo -65.17 106.21 0.79 Allowed 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 122.465 2.11 . . . . 0.0 110.31 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.457 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -119.1 129.27 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.071 -1.018 . . . . 0.0 110.428 -179.985 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.469 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 6.6 p -52.33 133.57 34.55 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 121.387 -0.82 . . . . 0.0 109.42 179.468 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 18.9 t-20 -34.34 -49.73 0.39 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.724 -0.61 . . . . 0.0 112.203 -178.445 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -46.82 -49.05 20.65 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.383 -0.823 . . . . 0.0 110.767 -179.424 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 27.1 m -62.56 -45.46 92.83 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.383 -0.823 . . . . 0.0 109.096 179.533 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.21 -30.59 64.4 Favored Glycine 0 N--CA 1.494 2.553 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 179.832 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 33' ' ' LEU . 60.6 mt -80.34 -63.12 1.48 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.391 -1.064 . . . . 0.0 109.8 -179.9 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -52.59 -35.17 53.67 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.32 -0.862 . . . . 0.0 109.174 179.635 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.6 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 8.5 t80 -66.37 -52.81 42.99 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.515 -0.74 . . . . 0.0 110.232 179.493 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -54.84 -28.42 49.68 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.135 -1.603 . . . . 0.0 109.985 -179.992 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mp -72.67 -64.37 0.97 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.083 -1.011 . . . . 0.0 110.662 -179.988 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.57 ' HB2' HG22 ' A' ' 40' ' ' VAL . 15.2 m80 -96.87 -28.01 14.42 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.141 -0.974 . . . . 0.0 110.653 -179.198 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.6 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.2 OUTLIER 76.08 26.53 0.98 Allowed 'General case' 0 N--CA 1.503 2.191 0 CA-C-O 121.599 0.714 . . . . 0.0 111.039 -179.929 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.57 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.0 m -113.91 166.93 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.035 -1.041 . . . . 0.0 109.848 178.63 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.8 p-10 -84.82 130.48 34.66 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.149 -0.969 . . . . 0.0 110.097 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -105.98 137.38 19.35 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.381 -0.825 . . . . 0.0 109.96 -179.554 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -63.57 145.53 91.85 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 122.237 1.958 . . . . 0.0 110.224 179.204 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.542 ' HB3' ' O ' ' A' ' 10' ' ' CYS . 1.7 pp -72.54 -4.23 29.35 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.206 -0.933 . . . . 0.0 110.943 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.64 -26.59 22.92 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.068 -1.02 . . . . 0.0 110.261 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -65.94 -26.37 67.56 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.899 -1.125 . . . . 0.0 109.685 179.17 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.02 165.68 24.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.182 -0.949 . . . . 0.0 109.687 179.475 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -127.96 -166.18 1.58 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.182 -0.949 . . . . 0.0 109.332 -179.938 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -46.83 -64.73 0.7 Allowed 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.315 -0.866 . . . . 0.0 109.958 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -117.74 -177.13 17.33 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.344 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.552 HG21 HG22 ' A' ' 16' ' ' THR . 5.3 mt -54.43 128.65 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.144 -1.21 . . . . 0.0 109.912 179.761 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.61 144.21 51.25 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.448 -0.782 . . . . 0.0 110.088 -179.933 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.16 160.92 41.28 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.373 -0.83 . . . . 0.0 109.549 178.959 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.67 -158.27 0.89 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.62 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -58.16 114.97 2.63 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.908 -1.12 . . . . 0.0 108.499 179.233 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.1 ttp180 -47.17 141.02 4.71 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.567 -0.708 . . . . 0.0 111.007 -178.622 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.801 0 O-C-N 121.585 -0.697 . . . . 0.0 109.74 179.754 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.733 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 4' ' ' GLY . . . . . 0.438 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 126.2 -12.49 7.16 Favored Glycine 0 N--CA 1.495 2.604 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 -179.333 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.512 HG23 ' CB ' ' A' ' 26' ' ' PRO . 17.4 m -54.4 100.58 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.025 -1.279 . . . . 0.0 108.942 179.188 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 4' ' ' GLY . 9.7 m -87.03 137.37 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 120.987 -1.071 . . . . 0.0 108.981 -179.454 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 31.9 t -67.02 117.57 9.26 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.335 -0.853 . . . . 0.0 110.583 -179.257 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.8 m -63.05 -7.61 5.8 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.381 -0.824 . . . . 0.0 110.545 178.913 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.429 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 2.4 m120 -109.82 -28.14 8.94 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.93 -1.106 . . . . 0.0 111.177 -179.389 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.53 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 14.6 p -142.5 17.22 2.03 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 120.501 -1.375 . . . . 0.0 111.59 -179.813 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 47.64 26.3 0.82 Allowed 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.21 -0.931 . . . . 0.0 112.116 178.576 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.458 ' H ' ' HB3' ' A' ' 7' ' ' CYS . 3.3 t -90.11 128.7 36.38 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.582 -1.324 . . . . 0.0 109.521 179.147 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.48 -27.99 19.97 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.849 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -88.8 106.59 18.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.483 -0.761 . . . . 0.0 109.562 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.613 HG21 ' CH2' ' A' ' 18' ' ' TRP . 17.8 p -128.34 157.05 42.05 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.449 -0.782 . . . . 0.0 110.212 -179.69 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.566 HG22 HG21 ' A' ' 51' ' ' ILE . 40.8 p -86.31 -39.68 16.25 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.946 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.605 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 23.3 mt -138.04 102.27 4.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.435 -0.79 . . . . 0.0 109.417 179.638 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.613 ' CH2' HG21 ' A' ' 15' ' ' THR . 5.7 m95 -62.9 106.76 0.86 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.39 -0.819 . . . . 0.0 110.148 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -97.42 73.87 2.44 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.445 -0.785 . . . . 0.0 109.384 179.828 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.494 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -67.04 112.37 4.35 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.224 -0.922 . . . . 0.0 109.124 179.898 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.04 150.99 97.41 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.178 -0.951 . . . . 0.0 109.434 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -52.81 -41.06 72.69 Favored 'Trans proline' 0 C--N 1.317 -1.091 0 C-N-CA 122.486 2.124 . . . . 0.0 111.186 -179.147 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -25.29 50.22 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.264 -0.897 . . . . 0.0 110.06 179.331 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.5 44.43 0.84 Allowed Glycine 0 N--CA 1.497 2.746 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 179.767 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -128.08 98.74 26.3 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.326 -1.103 . . . . 0.0 110.46 -179.652 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.531 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.0 Cg_endo -66.5 94.91 0.32 Allowed 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.372 2.048 . . . . 0.0 109.998 178.811 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.534 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -114.08 123.71 70.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 120.961 -1.087 . . . . 0.0 110.406 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.6 p -48.42 132.8 16.67 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.64 -0.663 . . . . 0.0 109.379 179.338 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.605 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t-20 -40.44 -40.98 1.31 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.658 -0.652 . . . . 0.0 111.568 -177.943 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.58 -43.98 56.7 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.96 -1.088 . . . . 0.0 110.478 179.773 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.429 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 13.3 m -65.73 -39.2 90.89 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.314 -0.866 . . . . 0.0 109.265 179.445 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.14 -53.98 12.69 Favored Glycine 0 N--CA 1.496 2.697 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.634 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 48.0 mt -57.32 -57.2 13.66 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.341 -1.094 . . . . 0.0 109.941 -179.462 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.554 ' OH ' ' HD2' ' A' ' 42' ' ' ARG . 78.5 t80 -50.67 -43.97 57.61 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.583 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.617 ' O ' ' N ' ' A' ' 39' ' ' GLN . 27.4 t80 -57.57 -54.79 42.82 Favored 'General case' 0 C--O 1.195 -1.811 0 O-C-N 121.502 -0.749 . . . . 0.0 109.402 179.456 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -49.42 -34.35 16.24 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 119.932 -1.73 . . . . 0.0 111.096 179.781 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 9.6 mp -57.94 -65.12 0.69 Allowed 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.082 -1.011 . . . . 0.0 110.408 -179.638 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 -99.11 -33.15 10.9 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.256 -0.903 . . . . 0.0 109.03 179.549 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.617 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 73.2 47.99 0.18 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.868 0.842 . . . . 0.0 110.099 179.088 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 m -140.57 166.26 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 178.544 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -77.61 145.52 36.73 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.854 -1.154 . . . . 0.0 109.396 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.554 ' HD2' ' OH ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -146.22 150.23 40.77 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 120.918 -1.114 . . . . 0.0 110.125 -179.686 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.441 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 5.9 Cg_exo -57.18 147.43 76.09 Favored 'Trans proline' 0 C--N 1.314 -1.243 0 C-N-CA 122.227 1.952 . . . . 0.0 110.796 -179.947 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.547 ' H ' HD23 ' A' ' 44' ' ' LEU . 0.4 OUTLIER -86.59 23.93 1.54 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.498 -0.751 . . . . 0.0 110.591 179.993 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 70.5 p -68.67 -12.69 61.69 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.999 -1.063 . . . . 0.0 110.336 179.374 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -86.11 -31.27 21.97 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.252 -0.905 . . . . 0.0 110.303 -179.83 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.488 ' HG2' ' N ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -80.62 158.49 25.67 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.11 -0.994 . . . . 0.0 109.775 -179.814 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.488 ' N ' ' HG2' ' A' ' 47' ' ' ARG . 10.3 tttp -131.78 173.56 11.04 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.054 -1.029 . . . . 0.0 109.93 179.78 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.48 -37.72 77.38 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.354 -0.841 . . . . 0.0 109.586 179.854 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -97.63 132.32 10.93 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 179.158 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.566 HG21 HG22 ' A' ' 16' ' ' THR . 4.8 mt -53.47 104.04 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.387 -1.066 . . . . 0.0 109.912 -179.626 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 52' ' ' GLN . . . . . 0.475 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 1.9 mt-30 -46.5 96.76 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.009 0 O-C-N 122.047 -0.408 . . . . 0.0 111.041 -179.363 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 51' ' ' ILE . 0.3 OUTLIER -121.86 153.04 38.91 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.949 -1.094 . . . . 0.0 110.859 179.583 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.55 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 1.6 ptm180 -154.17 -154.45 0.52 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 115.541 -0.754 . . . . 0.0 108.971 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 55' ' ' ASN . . . . . 0.48 ' N ' ' HG3' ' A' ' 54' ' ' ARG . 23.7 t-20 -58.54 121.09 10.1 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 177.988 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.14 -169.43 2.64 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.419 -0.8 . . . . 0.0 111.083 -178.449 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 O-C-N 121.305 -0.872 . . . . 0.0 109.645 179.904 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.923 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.9 -30.26 4.89 Favored Glycine 0 N--CA 1.496 2.682 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 -179.202 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' THR . . . . . 0.623 HG23 ' HB2' ' A' ' 26' ' ' PRO . 4.9 m -72.18 88.93 1.15 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.266 -1.138 . . . . 0.0 109.472 179.505 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 6' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 6' ' ' VAL . 15.9 m -78.73 120.19 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.124 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.562 ' HB2' HG22 ' A' ' 12' ' ' THR . 45.3 t -49.42 112.78 0.69 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.191 -0.943 . . . . 0.0 110.585 -178.411 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 71.0 m -57.19 -16.97 9.29 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.412 -0.805 . . . . 0.0 110.839 179.858 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' ASN . . . . . 0.472 ' CB ' ' SG ' ' A' ' 31' ' ' CYS . 25.3 m-20 -98.87 -31.01 12.07 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.002 -1.061 . . . . 0.0 111.437 -179.206 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 19.1 p -138.73 22.02 2.68 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.468 -1.395 . . . . 0.0 111.474 179.294 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.481 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER 44.59 21.02 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.303 -0.873 . . . . 0.0 112.692 178.851 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.562 HG22 ' HB2' ' A' ' 7' ' ' CYS . 6.1 t -80.78 130.48 35.09 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.579 -1.325 . . . . 0.0 109.749 179.927 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.0 p -90.47 -4.93 56.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.29 -0.881 . . . . 0.0 109.42 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.418 ' HB ' HG13 ' A' ' 51' ' ' ILE . 31.9 p -118.65 121.45 40.18 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -0.947 . . . . 0.0 110.085 -179.616 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.603 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 21.5 p -143.58 160.88 39.85 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.323 -0.861 . . . . 0.0 110.117 179.475 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.3 p -81.52 -47.45 13.1 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.877 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.545 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 10.9 mt -130.94 109.92 10.89 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.686 -0.633 . . . . 0.0 109.37 179.206 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.603 ' CZ2' HG23 ' A' ' 15' ' ' THR . 16.7 m95 -79.34 85.83 5.13 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.577 -0.702 . . . . 0.0 109.79 -179.615 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 19' ' ' ARG . . . . . 0.598 ' HD3' ' HA ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -77.57 93.64 4.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.073 -1.017 . . . . 0.0 109.335 179.556 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.477 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -68.06 124.21 22.77 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.33 -0.856 . . . . 0.0 110.149 -179.27 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -81.26 141.17 49.46 Favored Pre-proline 0 N--CA 1.499 1.989 0 O-C-N 121.361 -0.837 . . . . 0.0 109.559 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -54.36 -41.17 78.91 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 122.515 2.144 . . . . 0.0 110.933 -179.766 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.3 mtp -59.78 -20.44 56.74 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.32 -0.863 . . . . 0.0 109.95 179.386 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.54 39.66 1.44 Allowed Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 179.827 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -127.6 91.19 46.3 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.379 -1.071 . . . . 0.0 110.146 -179.818 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.623 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.6 Cg_endo -64.36 100.3 0.32 Allowed 'Trans proline' 0 C--N 1.311 -1.424 0 C-N-CA 122.203 1.935 . . . . 0.0 109.524 179.064 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.463 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.0 m -109.12 153.88 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 120.869 -1.144 . . . . 0.0 110.998 -179.476 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.507 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 16.0 p -81.8 138.88 35.06 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.598 ' HA ' ' HD3' ' A' ' 19' ' ' ARG . 6.0 t-20 -38.12 -36.64 0.22 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.781 -0.575 . . . . 0.0 111.812 -178.64 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.69 -43.07 81.01 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.271 -0.893 . . . . 0.0 111.76 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.472 ' SG ' ' CB ' ' A' ' 9' ' ' ASN . 1.8 m -57.98 -41.01 82.07 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.001 -1.062 . . . . 0.0 109.621 -179.671 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' GLY . . . . . 0.455 ' HA3' ' CZ ' ' A' ' 19' ' ' ARG . . . -74.02 -39.59 45.46 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 -179.925 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.5 ' HA ' HD23 ' A' ' 33' ' ' LEU . 25.0 mt -64.65 -65.15 0.71 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.484 -1.01 . . . . 0.0 110.26 -179.616 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.792 ' HA ' HD22 ' A' ' 37' ' ' LEU . 23.3 t80 -51.74 -39.98 59.44 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.233 -0.917 . . . . 0.0 108.843 179.77 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.485 ' O ' ' N ' ' A' ' 39' ' ' GLN . 60.2 t80 -53.59 -47.81 69.81 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.564 -0.71 . . . . 0.0 109.633 179.198 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -66.99 -38.67 86.44 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.208 -0.933 . . . . 0.0 110.14 -179.902 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.792 HD22 ' HA ' ' A' ' 34' ' ' TYR . 0.4 OUTLIER -45.27 -53.21 8.67 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.293 -0.879 . . . . 0.0 110.031 -179.564 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.543 ' CB ' HG22 ' A' ' 40' ' ' VAL . 50.8 m80 -111.53 6.37 20.07 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.351 -0.843 . . . . 0.0 109.549 179.156 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 35' ' ' TYR . 3.2 tp-100 49.22 32.67 4.42 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.431 -0.793 . . . . 0.0 110.133 -178.751 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.543 HG22 ' CB ' ' A' ' 38' ' ' HIS . 4.0 m -134.08 -174.44 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.503 -0.748 . . . . 0.0 109.558 179.826 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -61.97 172.5 1.35 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.237 -0.915 . . . . 0.0 110.319 179.574 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.597 ' HB3' ' CD1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -133.36 131.38 21.51 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.24 -0.912 . . . . 0.0 109.451 -179.867 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.24 112.93 1.85 Allowed 'Trans proline' 0 C--N 1.315 -1.218 0 C-N-CA 122.135 1.89 . . . . 0.0 110.335 179.857 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -72.74 -7.24 49.61 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.21 -0.931 . . . . 0.0 110.378 179.779 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 75.0 p -54.42 -20.66 7.9 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.05 -1.031 . . . . 0.0 110.003 178.631 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.03 -15.36 62.55 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.139 -0.975 . . . . 0.0 110.725 179.627 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 12.0 mmm180 -56.56 148.03 20.69 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 120.719 -1.238 . . . . 0.0 110.24 -179.785 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.85 -162.92 1.27 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.42 -0.8 . . . . 0.0 109.852 -179.916 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -79.99 -41.17 26.4 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.12 -0.988 . . . . 0.0 109.884 179.982 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -133.15 165.89 23.88 Favored Glycine 0 N--CA 1.498 2.793 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.418 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.4 mt -56.59 125.87 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.195 -1.18 . . . . 0.0 109.973 179.87 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.63 154.53 32.58 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.561 -0.712 . . . . 0.0 109.589 179.247 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.84 165.32 36.83 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.977 -1.077 . . . . 0.0 109.252 179.1 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.435 HH11 ' CG ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -150.46 -172.68 4.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.539 -0.725 . . . . 0.0 109.382 -179.421 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -51.69 118.69 3.55 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.106 -0.996 . . . . 0.0 108.718 179.228 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -47.43 140.58 5.62 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.581 -0.7 . . . . 0.0 110.351 -178.985 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.2 ttmt . . . . . 0 N--CA 1.497 1.891 0 O-C-N 121.581 -0.699 . . . . 0.0 110.149 -179.742 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.3 -23.83 5.41 Favored Glycine 0 N--CA 1.496 2.649 0 N-CA-C 109.266 -1.534 . . . . 0.0 109.266 -178.947 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.0 m -69.13 93.36 0.59 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.31 -1.112 . . . . 0.0 109.843 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.68 129.74 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 178.41 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' CYS . . . . . 0.508 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 6.9 t -45.13 111.98 0.39 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.523 -0.736 . . . . 0.0 111.132 -178.638 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -60.58 -13.32 13.53 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.25 -0.906 . . . . 0.0 110.671 179.679 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -105.03 -28.59 10.96 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.776 -1.203 . . . . 0.0 111.589 -179.309 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' CYS . . . . . 0.623 ' SG ' ' HD2' ' A' ' 47' ' ' ARG . 9.4 p -138.71 24.7 2.62 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.637 -1.289 . . . . 0.0 110.59 179.005 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 11' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 1.3 pt20 38.45 25.98 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 179.132 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' THR . . . . . 0.466 HG22 ' HB2' ' A' ' 7' ' ' CYS . 3.8 t -90.1 124.18 34.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.589 -1.319 . . . . 0.0 109.816 179.228 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.07 -23.96 21.28 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.447 -0.783 . . . . 0.0 109.711 -179.867 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 14' ' ' THR . . . . . 0.513 ' HB ' HG13 ' A' ' 51' ' ' ILE . 2.9 p -89.86 94.13 9.7 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.225 -0.922 . . . . 0.0 109.173 179.807 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 15' ' ' THR . . . . . 0.544 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 5.2 p -117.71 149.59 40.5 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.269 -0.895 . . . . 0.0 110.059 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' THR . . . . . 0.513 HG22 HG21 ' A' ' 51' ' ' ILE . 30.7 p -74.04 -33.72 63.83 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 179.145 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 17' ' ' LEU . . . . . 0.423 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 73.3 mt -146.32 108.52 4.42 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.34 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 18' ' ' TRP . . . . . 0.544 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.6 m95 -65.39 86.33 0.07 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.382 -0.824 . . . . 0.0 109.696 -179.774 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -76.98 80.25 3.52 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.433 -0.792 . . . . 0.0 109.381 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ARG . . . . . 0.486 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -57.91 123.45 15.84 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.364 -0.835 . . . . 0.0 109.594 -179.832 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 t -78.58 145.99 68.53 Favored Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.346 -0.846 . . . . 0.0 109.912 -179.599 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -58.76 -23.17 65.28 Favored 'Trans proline' 0 C--N 1.319 -1.024 0 C-N-CA 122.443 2.095 . . . . 0.0 110.482 179.185 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.04 1.28 21.47 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.207 -0.933 . . . . 0.0 110.307 179.309 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.85 29.89 16.72 Favored Glycine 0 N--CA 1.497 2.741 0 N-CA-C 109.412 -1.475 . . . . 0.0 109.412 -179.562 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -121.34 101.03 44.4 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.406 -1.055 . . . . 0.0 110.339 -179.419 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 3.2 Cg_exo -63.11 99.69 0.23 Allowed 'Trans proline' 0 C--N 1.311 -1.417 0 C-N-CA 121.997 1.798 . . . . 0.0 109.605 178.48 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.508 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 1.6 m -110.34 154.56 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 CA-C-O 122.292 1.044 . . . . 0.0 111.024 -179.77 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.405 ' O ' ' C ' ' A' ' 29' ' ' ASN . 15.7 p -81.14 138.37 35.9 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.689 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 29' ' ' ASN . . . . . 0.423 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 3.5 t-20 -35.22 -46.8 0.37 Allowed 'General case' 0 N--CA 1.504 2.275 0 O-C-N 121.657 -0.652 . . . . 0.0 112.093 -178.551 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' ALA . . . . . 0.437 ' HB3' HH12 ' A' ' 47' ' ' ARG . . . -55.15 -47.26 75.37 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.377 -0.827 . . . . 0.0 111.472 -179.339 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 31' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 3.4 m -57.19 -38.66 73.98 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.091 -1.006 . . . . 0.0 109.81 179.966 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -72.92 -36.52 57.36 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.991 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 37' ' ' LEU . 81.0 mt -73.15 -66.22 0.71 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.432 -1.04 . . . . 0.0 110.09 -179.851 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 34' ' ' TYR . . . . . 0.464 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 80.2 t80 -46.34 -34.46 4.58 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.357 -0.839 . . . . 0.0 109.173 179.655 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 35' ' ' TYR . . . . . 0.632 ' O ' ' N ' ' A' ' 39' ' ' GLN . 30.5 t80 -63.47 -62.58 1.58 Allowed 'General case' 0 C--O 1.193 -1.886 0 O-C-N 121.285 -0.885 . . . . 0.0 109.009 178.746 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 tttm -48.06 -30.41 4.41 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 120.084 -1.635 . . . . 0.0 110.799 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 33' ' ' LEU . 9.6 mp -57.33 -69.52 0.16 Allowed 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.198 -0.939 . . . . 0.0 109.971 179.734 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' HIS . . . . . 0.543 ' HB2' HG22 ' A' ' 40' ' ' VAL . 17.6 m-70 -99.38 -28.74 13.14 Favored 'General case' 0 N--CA 1.506 2.34 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.039 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.632 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.9 OUTLIER 76.19 49.0 0.07 Allowed 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 122.059 0.933 . . . . 0.0 110.346 179.21 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 40' ' ' VAL . . . . . 0.543 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.8 m -133.44 -178.87 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.558 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -59.1 161.05 5.53 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.641 -1.287 . . . . 0.0 110.022 179.779 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' ARG . . . . . 0.499 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -127.21 106.69 21.69 Favored Pre-proline 0 N--CA 1.498 1.962 0 O-C-N 121.041 -1.037 . . . . 0.0 109.759 -179.12 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.16 141.93 90.08 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 122.353 2.035 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' LEU . . . . . 0.643 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -84.8 5.52 28.3 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.257 -0.902 . . . . 0.0 110.785 179.953 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 54.6 p -61.24 -26.7 67.93 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.461 -1.399 . . . . 0.0 109.696 179.054 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.65 4.19 33.57 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.133 -0.979 . . . . 0.0 110.821 179.79 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 47' ' ' ARG . . . . . 0.623 ' HD2' ' SG ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -82.35 -174.9 5.41 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.567 -1.333 . . . . 0.0 109.621 179.636 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -151.43 156.9 41.59 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.124 -0.985 . . . . 0.0 109.416 179.793 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -55.03 -35.2 64.19 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.295 -0.878 . . . . 0.0 109.792 179.878 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.88 146.92 16.63 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 109.071 -1.612 . . . . 0.0 109.071 179.033 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' ILE . . . . . 0.513 HG13 ' HB ' ' A' ' 14' ' ' THR . 6.0 mt -50.22 120.62 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.345 -1.091 . . . . 0.0 109.852 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.79 151.57 33.81 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.404 -0.81 . . . . 0.0 109.563 179.814 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 53' ' ' THR . . . . . 0.431 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -155.49 165.04 37.82 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.266 -0.896 . . . . 0.0 109.419 179.445 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 54' ' ' ARG . . . . . 0.482 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 2.1 mtm-85 -145.64 -152.49 0.43 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.625 -0.672 . . . . 0.0 109.709 -179.5 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.58 122.56 16.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.112 -0.993 . . . . 0.0 109.105 179.324 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.06 112.82 0.48 Allowed 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.446 0.641 . . . . 0.0 110.752 -179.171 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.389 -0.819 . . . . 0.0 109.287 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.54 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.674 0 O4'-C1'-N19 110.345 3.182 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.54 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.732 1 O4'-C1'-N19 111.414 4.518 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.583 ' H61' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.527 2.062 0 O4'-C1'-N19 110.723 3.654 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.583 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.01 0 O4'-C1'-N19 110.65 3.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.536 H2'' ' C8 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.824 0 O4'-C1'-N19 110.717 3.646 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.536 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.012 0 O4'-C1'-N19 110.755 3.694 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.457 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.825 1 O4'-C1'-N19 111.281 4.351 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.457 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.806 0 C3'-C2'-C1' 107.198 3.213 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.679 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.792 0 O4'-C1'-N19 110.865 3.831 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.679 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.227 1 O4'-C1'-N19 111.827 5.033 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.611 ' P ' HD23 ' A' ' 37' ' ' LEU . . . . . . . . 0 C5'--C4' 1.527 2.028 1 O4'-C1'-N19 111.081 4.101 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.57 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 P--O5' 1.611 1.763 0 O4'-C1'-N19 110.6 3.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.681 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.477 1 O4'-C1'-N19 111.082 4.102 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.529 ' H71' " H2'" ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.564 1 O4'-C1'-N19 111.856 5.07 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.48 " H2'" ' H71' ' C' ' 127' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.497 0 O4'-C1'-N19 110.946 3.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.48 ' H71' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.959 1 O4'-C1'-N19 111.086 4.108 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 2.011 0 CA-C-O 120.745 0.307 . . . . 0.0 110.321 . . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.28 -31.69 72.99 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.085 -1.009 . . . . 0.0 110.092 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -51.91 138.6 24.1 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.299 -0.876 . . . . 0.0 109.619 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.32 -31.77 7.8 Favored Glycine 0 N--CA 1.494 2.549 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.603 HG23 ' HB2' ' A' ' 26' ' ' PRO . 3.5 m -63.5 91.69 0.06 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.343 -1.092 . . . . 0.0 109.137 178.984 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 m -88.93 122.17 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.516 ' CB ' HG22 ' A' ' 12' ' ' THR . 49.5 t -49.57 118.06 2.57 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.336 -0.853 . . . . 0.0 110.602 -178.662 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.1 m -65.33 -7.71 14.81 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.411 -0.806 . . . . 0.0 111.115 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.63 ' OD1' HG11 ' A' ' 27' ' ' VAL . 6.8 m120 -107.78 -23.64 12.0 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 120.732 -1.23 . . . . 0.0 110.858 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.534 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 14.0 p -145.41 20.63 1.53 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.669 -1.269 . . . . 0.0 111.176 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER 45.05 20.31 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.451 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 178.71 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.516 HG22 ' CB ' ' A' ' 7' ' ' CYS . 14.1 t -77.4 135.78 38.35 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.34 -1.475 . . . . 0.0 109.655 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.3 p -95.0 -21.37 18.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.536 -0.728 . . . . 0.0 109.347 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.505 ' HB ' HG13 ' A' ' 51' ' ' ILE . 72.3 p -109.45 120.31 42.1 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.249 -0.907 . . . . 0.0 109.772 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.584 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 4.4 p -135.71 159.77 40.62 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.279 -0.888 . . . . 0.0 109.591 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.681 HG21 " H3'" ' C' ' 124' ' ' ' DA' . 6.0 p -83.54 -30.77 26.81 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.562 -0.711 . . . . 0.0 109.205 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.61 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 45.9 mt -142.13 91.3 2.33 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.345 -0.847 . . . . 0.0 109.371 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.568 ' CZ2' HG23 ' A' ' 15' ' ' THR . 18.5 m95 -64.2 109.1 1.75 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.296 -0.877 . . . . 0.0 109.806 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.566 ' HG3' ' O ' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -98.85 130.32 45.26 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.224 -0.922 . . . . 0.0 109.403 179.651 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.8 mmm180 -96.38 119.8 35.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.16 -0.963 . . . . 0.0 109.745 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.6 t -79.21 142.8 59.56 Favored Pre-proline 0 N--CA 1.499 2.018 0 O-C-N 121.206 -0.934 . . . . 0.0 109.478 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -54.32 -41.61 74.87 Favored 'Trans proline' 0 C--N 1.32 -0.959 0 C-N-CA 122.655 2.237 . . . . 0.0 111.0 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.7 mtm -62.05 -21.06 64.61 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.268 -0.895 . . . . 0.0 109.412 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.02 44.66 1.08 Allowed Glycine 0 N--CA 1.497 2.753 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -129.28 98.94 22.14 Favored Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.155 -1.203 . . . . 0.0 110.822 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.603 ' HB2' HG23 ' A' ' 5' ' ' THR . 1.8 Cg_endo -65.97 107.09 1.06 Allowed 'Trans proline' 0 C--N 1.314 -1.247 0 C-N-CA 122.101 1.867 . . . . 0.0 109.241 178.244 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.63 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.0 m -122.88 126.28 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 O-C-N 121.135 -0.978 . . . . 0.0 110.506 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.584 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.2 p -48.06 131.12 15.87 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.404 -0.81 . . . . 0.0 109.839 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.61 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 5.6 t-20 -35.09 -43.68 0.21 Allowed 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.837 -0.54 . . . . 0.0 112.156 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.462 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -51.43 -45.42 62.63 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.276 -0.89 . . . . 0.0 110.606 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.475 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 18.6 m -64.75 -37.44 87.59 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.331 -0.856 . . . . 0.0 108.999 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.29 -53.53 25.05 Favored Glycine 0 N--CA 1.495 2.602 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.529 ' O ' HD13 ' A' ' 37' ' ' LEU . 93.7 mt -55.74 -58.44 7.81 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.503 -0.998 . . . . 0.0 109.877 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.691 ' HA ' HD22 ' A' ' 37' ' ' LEU . 11.4 t80 -47.28 -42.62 21.24 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.489 -0.757 . . . . 0.0 109.749 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.417 ' O ' ' N ' ' A' ' 39' ' ' GLN . 40.4 t80 -52.29 -46.99 66.13 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.374 -0.829 . . . . 0.0 109.979 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.4 -38.1 77.8 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 120.82 -1.175 . . . . 0.0 110.206 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.691 HD22 ' HA ' ' A' ' 34' ' ' TYR . 6.0 mp -42.97 -52.46 5.19 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.565 -0.709 . . . . 0.0 110.16 -179.326 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.465 ' CB ' HG22 ' A' ' 40' ' ' VAL . 78.6 m-70 -121.37 12.13 10.84 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.18 -0.95 . . . . 0.0 110.082 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.417 ' N ' ' O ' ' A' ' 35' ' ' TYR . 8.4 tt0 50.13 34.92 9.13 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.356 -0.84 . . . . 0.0 110.141 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.465 HG22 ' CB ' ' A' ' 38' ' ' HIS . 2.9 m -135.96 -165.42 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 O-C-N 121.313 -0.867 . . . . 0.0 109.203 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.7 p30 -62.93 -173.82 0.06 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.224 -0.922 . . . . 0.0 110.254 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.475 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -146.41 106.97 4.11 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.283 -0.885 . . . . 0.0 109.884 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.511 ' HD2' ' CZ ' ' A' ' 34' ' ' TYR . 3.5 Cg_exo -60.34 128.01 24.8 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 C-N-CA 122.234 1.956 . . . . 0.0 110.08 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.672 ' H ' HD23 ' A' ' 44' ' ' LEU . 0.9 OUTLIER -93.3 25.48 3.34 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.335 -0.853 . . . . 0.0 110.884 -179.299 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -6.91 29.67 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.031 -1.043 . . . . 0.0 110.849 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 57.8 mtm -102.93 -7.82 21.19 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.871 -1.143 . . . . 0.0 110.61 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.518 ' NH1' ' HG3' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -81.64 164.76 21.61 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.869 -1.144 . . . . 0.0 110.451 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.2 -169.12 3.23 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.365 -0.835 . . . . 0.0 109.719 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -78.84 -9.53 59.5 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.093 -1.004 . . . . 0.0 110.699 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -137.17 145.08 16.8 Favored Glycine 0 N--CA 1.499 2.882 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.505 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.1 mt -54.18 124.3 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.405 -1.056 . . . . 0.0 110.108 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.49 159.59 33.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.451 -0.781 . . . . 0.0 109.4 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.32 163.34 40.25 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.011 -1.055 . . . . 0.0 109.378 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -149.86 -163.26 1.74 Allowed 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.4 93.93 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.042 -1.036 . . . . 0.0 108.515 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.36 150.19 1.36 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.566 -0.709 . . . . 0.0 109.972 -179.317 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt -51.55 126.03 16.3 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.358 -0.839 . . . . 0.0 109.641 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.2 p -43.99 129.22 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.711 -0.618 . . . . 0.0 110.465 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.47 65.93 0.95 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 30.6 t . . . . . 0 N--CA 1.498 1.929 0 O-C-N 121.157 -0.964 . . . . 0.0 109.071 -179.702 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.517 ' C6 ' ' C6 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.667 0 O4'-C1'-N19 110.75 3.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.517 ' C6 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.74 1 O4'-C1'-N19 111.584 4.73 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.404 " O5'" H2'' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.353 1 O4'-C1'-N19 111.012 4.014 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.518 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.406 1 O4'-C1'-N19 111.472 4.59 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.518 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C1'-N19 110.504 3.381 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.648 0 O4'-C1'-N19 110.759 3.699 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.441 1.598 1 O4'-C1'-N19 111.361 4.451 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.409 " H5'" ' CZ ' ' A' ' 54' ' ' ARG . . . . . . . . 0 O4'--C1' 1.442 1.711 0 O4'-C1'-N19 110.755 3.694 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.611 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.987 0 O4'-C1'-N19 110.823 3.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.611 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.58 1 O4'-C1'-N19 111.938 5.173 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.598 ' H71' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.564 1 O4'-C1'-N19 111.148 4.185 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.527 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 P--O5' 1.612 1.872 0 O4'-C1'-N19 110.501 3.376 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.832 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.355 0 O4'-C1'-N19 110.499 3.374 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.641 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.528 2.178 1 O4'-C1'-N19 112.356 5.696 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.49 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.705 0 O4'-C1'-N19 110.916 3.895 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.401 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.781 0 O4'-C1'-N19 110.686 3.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.97 0 N-CA-C 111.389 0.144 . . . . 0.0 111.389 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -86.58 62.06 7.19 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.499 -1.376 . . . . 0.0 109.971 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.78 123.67 18.18 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.201 -0.937 . . . . 0.0 109.054 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.44 -30.44 3.45 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.369 -1.493 . . . . 0.0 109.369 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.471 HG22 ' CH2' ' A' ' 18' ' ' TRP . 72.8 m -72.09 86.15 1.04 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.088 -1.242 . . . . 0.0 109.316 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 6' ' ' VAL . 28.3 m -88.46 112.81 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.528 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 52.9 t -47.99 108.05 0.15 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.466 -0.771 . . . . 0.0 110.732 -178.43 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.9 m -59.76 -14.96 16.84 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.309 -0.869 . . . . 0.0 111.129 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.539 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 4.5 m-20 -90.36 -30.11 17.63 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.032 -1.043 . . . . 0.0 110.739 -179.788 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.788 ' HA ' HD22 ' A' ' 44' ' ' LEU . 16.3 p -143.25 23.81 1.82 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.627 -1.296 . . . . 0.0 110.908 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.469 ' N ' ' O ' ' A' ' 7' ' ' CYS . 7.1 mt-30 44.61 22.56 0.06 Allowed 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.354 -0.842 . . . . 0.0 112.201 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.604 HG22 ' SG ' ' A' ' 10' ' ' CYS . 6.7 t -89.19 125.63 35.15 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.515 -1.366 . . . . 0.0 110.051 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.6 t -90.96 -17.11 26.91 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.638 -0.664 . . . . 0.0 109.639 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.529 ' HB ' HG13 ' A' ' 51' ' ' ILE . 23.0 p -101.42 115.63 30.93 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.252 -0.905 . . . . 0.0 109.035 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.529 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 6.9 p -135.44 153.17 51.86 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.218 -0.926 . . . . 0.0 110.211 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.832 HG21 " H3'" ' C' ' 124' ' ' ' DA' . 40.7 p -83.43 -34.74 25.4 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.575 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 35.4 mt -137.61 96.96 3.34 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.475 -0.766 . . . . 0.0 109.312 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CZ3' HG21 ' A' ' 15' ' ' THR . 8.6 m95 -62.93 110.96 1.95 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.153 -0.967 . . . . 0.0 109.843 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.34 104.51 14.13 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.358 -0.839 . . . . 0.0 109.237 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.456 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -73.21 115.14 12.19 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.098 . . . . 0.0 108.812 179.784 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.537 ' HB3' ' HG2' ' A' ' 23' ' ' MET . 0.2 OUTLIER -67.95 144.49 97.2 Favored Pre-proline 0 N--CA 1.5 2.064 0 O-C-N 121.21 -0.931 . . . . 0.0 110.293 -179.118 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -55.18 -40.84 83.68 Favored 'Trans proline' 0 C--N 1.319 -1.013 0 C-N-CA 122.867 2.378 . . . . 0.0 110.952 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.537 ' HG2' ' HB3' ' A' ' 21' ' ' SER . 1.4 ptt? -54.73 -23.8 19.34 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.401 -0.812 . . . . 0.0 109.986 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.57 37.18 1.47 Allowed Glycine 0 N--CA 1.497 2.713 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -136.23 116.19 11.13 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 120.864 -1.374 . . . . 0.0 110.322 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 5.1 Cg_exo -62.06 106.13 0.44 Allowed 'Trans proline' 0 C--N 1.316 -1.177 0 C-N-CA 122.321 2.014 . . . . 0.0 110.026 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.528 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.8 m -120.37 126.01 74.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.104 -0.997 . . . . 0.0 110.665 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.408 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 9.7 p -49.27 133.67 19.13 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 121.443 0.64 . . . . 0.0 109.456 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.575 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 8.1 t-20 -37.9 -45.43 0.86 Allowed 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.578 -0.701 . . . . 0.0 111.577 -178.961 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.71 -46.49 40.77 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.208 -0.933 . . . . 0.0 110.96 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.539 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 6.9 m -60.24 -47.05 87.62 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.006 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.44 -32.44 64.38 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 109.626 -1.389 . . . . 0.0 109.626 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.537 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 81.9 mt -75.85 -64.01 1.18 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.512 -0.993 . . . . 0.0 109.284 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.487 ' HA ' HD22 ' A' ' 37' ' ' LEU . 9.3 t80 -47.13 -38.71 12.02 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.055 -1.028 . . . . 0.0 109.143 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.438 ' O ' ' N ' ' A' ' 39' ' ' GLN . 31.5 t80 -60.18 -49.54 77.23 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.48 -0.763 . . . . 0.0 109.787 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -62.06 -25.5 67.72 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.671 -1.268 . . . . 0.0 110.671 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.487 HD22 ' HA ' ' A' ' 34' ' ' TYR . 6.5 mp -62.19 -63.75 1.14 Allowed 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.206 -0.934 . . . . 0.0 110.268 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.529 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 69.8 m-70 -106.93 13.47 27.63 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.322 -0.862 . . . . 0.0 110.366 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 3.1 pm0 42.98 33.02 0.46 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.679 -0.638 . . . . 0.0 111.219 -179.557 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 38' ' ' HIS . 5.4 m -136.01 164.72 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 O-C-N 121.15 -0.969 . . . . 0.0 110.176 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -84.45 136.31 33.9 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.438 -0.789 . . . . 0.0 108.974 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.4 ' HA ' ' HD3' ' A' ' 43' ' ' PRO . 2.5 mpt_? -131.78 148.07 68.5 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 121.273 -0.892 . . . . 0.0 109.994 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 42' ' ' ARG . 1.7 Cg_endo -63.02 144.33 92.67 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 122.44 2.093 . . . . 0.0 111.011 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.788 HD22 ' HA ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -84.49 41.63 0.85 Allowed 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.503 -0.748 . . . . 0.0 110.709 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.4 p -63.78 -17.32 62.95 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.136 -0.977 . . . . 0.0 110.373 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 32.6 ttp -97.45 -2.12 42.78 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.122 -0.986 . . . . 0.0 110.609 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.451 ' HB2' ' HB2' ' A' ' 44' ' ' LEU . 1.8 tpt180 -63.64 145.04 56.49 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 120.645 -1.285 . . . . 0.0 110.486 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.97 -176.27 2.86 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.405 -0.809 . . . . 0.0 109.943 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -78.45 -40.7 34.92 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.633 -0.667 . . . . 0.0 110.177 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.43 165.76 19.49 Favored Glycine 0 N--CA 1.5 2.937 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.636 HG21 HG22 ' A' ' 16' ' ' THR . 5.8 mt -58.13 123.78 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.52 -0.988 . . . . 0.0 110.217 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.86 159.29 31.12 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.556 -0.715 . . . . 0.0 109.856 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.98 162.91 40.28 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.272 -0.892 . . . . 0.0 109.275 179.079 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.415 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -150.59 -161.82 1.42 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.703 -0.623 . . . . 0.0 109.323 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.74 91.83 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.003 -1.061 . . . . 0.0 108.716 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.43 130.69 16.87 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.602 -0.686 . . . . 0.0 110.215 -178.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.35 132.61 44.37 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.504 -0.748 . . . . 0.0 110.008 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.412 HG12 ' N ' ' A' ' 59' ' ' SER . 44.1 t -85.02 160.46 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.501 -0.749 . . . . 0.0 109.133 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.412 ' N ' HG12 ' A' ' 58' ' ' VAL . 7.9 t -53.59 108.72 0.37 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.208 -0.932 . . . . 0.0 109.865 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.499 2.018 0 O-C-N 121.622 -0.674 . . . . 0.0 109.98 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.557 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.444 1.82 0 O4'-C1'-N19 110.361 3.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.682 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.525 1.716 1 O4'-C1'-N19 111.408 4.51 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.62 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.827 0 O4'-C1'-N19 110.847 3.808 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.62 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.685 1 O4'-C1'-N19 111.089 4.111 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.528 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.797 0 O4'-C1'-N19 110.832 3.79 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.484 " O5'" H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.441 1.597 0 O4'-C1'-N19 110.796 3.745 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.437 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.566 1 O4'-C1'-N19 111.365 4.456 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.76 0 O4'-C1'-N19 110.634 3.543 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.638 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.651 1 O4'-C1'-N19 111.677 4.846 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.638 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.468 1 O4'-C1'-N19 111.926 5.158 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.452 ' C5 ' ' C2 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.802 1 O4'-C1'-N19 111.475 4.594 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.497 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.416 0 O4'-C1'-N19 110.582 3.477 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.541 " H2'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.51 0 O4'-C1'-N19 110.973 3.966 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.723 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.466 1 O4'-C1'-N19 112.127 5.409 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.547 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.186 0 O4'-C1'-N19 110.969 3.962 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.45 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.532 2.649 0 O4'-C1'-N19 110.813 3.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt . . . . . 0 N--CA 1.497 1.921 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.06 59.57 1.41 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.139 -0.976 . . . . 0.0 109.804 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.31 124.62 18.65 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.335 -0.853 . . . . 0.0 109.214 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.84 -45.7 1.14 Allowed Glycine 0 N--CA 1.494 2.563 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.432 ' HB ' ' CZ2' ' A' ' 18' ' ' TRP . 3.9 m -65.43 102.51 0.7 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.118 -1.225 . . . . 0.0 109.503 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.9 m -104.01 113.22 40.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 43.7 t -51.1 107.31 0.17 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 109.536 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.6 m -57.79 -17.77 17.79 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.099 -1.0 . . . . 0.0 110.918 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.505 ' OD1' HG11 ' A' ' 27' ' ' VAL . 3.0 m120 -86.14 -30.88 22.17 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.102 -0.999 . . . . 0.0 111.016 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.5 p -142.72 23.02 1.95 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.571 -1.33 . . . . 0.0 111.437 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 7' ' ' CYS . 13.0 mm100 42.29 35.35 0.6 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.5 -0.75 . . . . 0.0 112.386 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.552 HG22 ' CB ' ' A' ' 7' ' ' CYS . 5.2 t -90.56 135.47 33.68 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.643 -1.286 . . . . 0.0 109.671 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.4 p -93.72 -18.46 22.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.537 -0.727 . . . . 0.0 109.749 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.524 ' HB ' HG13 ' A' ' 51' ' ' ILE . 69.3 p -111.58 126.11 54.65 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.023 -1.048 . . . . 0.0 109.329 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.405 ' O ' HD11 ' A' ' 51' ' ' ILE . 11.9 p -138.44 151.79 47.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.206 -0.934 . . . . 0.0 110.496 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.723 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 73.3 p -77.1 -32.75 56.82 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.682 HD11 ' O6 ' ' B' ' 107' ' ' ' DG' . 52.4 mt -146.46 110.14 4.88 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 179.0 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.432 ' CZ2' ' HB ' ' A' ' 5' ' ' THR . 13.2 m95 -72.29 120.25 17.63 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.088 -1.008 . . . . 0.0 110.373 -179.194 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -106.51 82.17 1.69 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.491 -0.755 . . . . 0.0 109.45 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.466 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 6.7 tpp180 -60.95 118.45 6.73 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.418 -0.801 . . . . 0.0 109.377 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.481 ' HB3' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -82.63 143.53 47.41 Favored Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 121.326 -0.858 . . . . 0.0 109.785 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -55.97 -41.8 73.39 Favored 'Trans proline' 0 C--N 1.321 -0.89 0 C-N-CA 122.649 2.233 . . . . 0.0 111.103 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 mmt -56.39 -24.2 43.07 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.261 -0.899 . . . . 0.0 109.506 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.55 36.97 1.5 Allowed Glycine 0 N--CA 1.497 2.745 0 N-CA-C 109.914 -1.275 . . . . 0.0 109.914 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.481 ' O ' ' HB3' ' A' ' 21' ' ' SER . 15.2 m-20 -134.18 99.22 13.58 Favored Pre-proline 0 N--CA 1.495 1.775 0 O-C-N 121.192 -1.181 . . . . 0.0 110.388 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.558 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.8 Cg_endo -63.54 118.67 5.59 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 C-N-CA 122.039 1.826 . . . . 0.0 110.208 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.505 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.1 m -125.28 128.82 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 CA-C-O 121.868 0.842 . . . . 0.0 110.3 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.6 p -53.39 135.51 39.1 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.296 0.57 . . . . 0.0 109.73 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.633 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 22.9 t-20 -38.33 -47.2 1.19 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.627 -0.67 . . . . 0.0 112.035 -178.654 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.57 -46.13 27.74 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.223 -0.923 . . . . 0.0 110.858 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 22.6 m -65.48 -42.93 91.66 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.256 -0.903 . . . . 0.0 108.789 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.01 -50.37 66.13 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 110.459 -1.056 . . . . 0.0 110.459 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.559 HD23 ' CE ' ' A' ' 36' ' ' LYS . 68.1 mt -59.04 -66.72 0.46 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.369 -1.077 . . . . 0.0 109.608 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.524 ' CZ ' ' HG3' ' A' ' 42' ' ' ARG . 29.8 t80 -43.84 -38.46 3.32 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.558 -0.714 . . . . 0.0 109.687 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.548 ' O ' ' N ' ' A' ' 39' ' ' GLN . 15.9 t80 -62.02 -46.12 90.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.307 -0.87 . . . . 0.0 110.591 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.559 ' CE ' HD23 ' A' ' 33' ' ' LEU . 0.1 OUTLIER -60.37 -22.34 63.19 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.219 -1.551 . . . . 0.0 110.251 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.583 HD12 ' N ' ' A' ' 37' ' ' LEU . 7.2 mp -82.11 -55.54 4.5 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.021 -1.049 . . . . 0.0 110.027 -179.291 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.471 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 34.5 m-70 -97.44 -27.33 14.5 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.249 -0.907 . . . . 0.0 110.49 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 70.35 24.44 4.71 Favored 'General case' 0 N--CA 1.502 2.168 0 CA-C-O 121.591 0.71 . . . . 0.0 111.204 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.6 m -124.83 164.6 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 121.015 -1.053 . . . . 0.0 109.984 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -83.55 151.6 25.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.513 -0.742 . . . . 0.0 109.773 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.524 ' HG3' ' CZ ' ' A' ' 34' ' ' TYR . 13.2 mmt180 -133.84 147.65 65.11 Favored Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.387 -0.82 . . . . 0.0 110.002 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.479 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 1.0 OUTLIER -65.64 150.41 86.42 Favored 'Trans proline' 0 C--N 1.316 -1.145 0 C-N-CA 122.541 2.161 . . . . 0.0 110.656 179.671 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' ARG . 1.0 OUTLIER -68.6 0.92 3.57 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.192 -0.942 . . . . 0.0 110.876 179.462 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -35.08 45.46 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.936 -1.102 . . . . 0.0 110.257 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.59 -29.14 41.1 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.11 -0.994 . . . . 0.0 109.724 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.472 ' HB3' ' O ' ' A' ' 44' ' ' LEU . 0.5 OUTLIER -50.16 142.6 9.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.325 -0.859 . . . . 0.0 110.09 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.48 172.27 7.63 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.469 -0.769 . . . . 0.0 109.859 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -66.53 -66.25 0.58 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.337 -0.852 . . . . 0.0 109.853 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -117.0 164.4 12.41 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.524 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.0 mt -46.49 123.1 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.468 -1.019 . . . . 0.0 110.311 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -77.18 166.54 23.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.364 -0.835 . . . . 0.0 109.482 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.511 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.67 162.21 40.62 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.335 -0.853 . . . . 0.0 108.985 178.704 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -143.32 -162.06 1.38 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.54 -0.725 . . . . 0.0 109.661 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -62.42 117.14 5.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.98 -1.075 . . . . 0.0 109.089 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.408 ' HD3' " O3'" ' C' ' 125' ' ' ' DT' . 0.0 OUTLIER -49.53 134.63 19.27 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.541 -0.725 . . . . 0.0 110.898 -178.862 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt -62.81 148.06 48.09 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.64 -0.662 . . . . 0.0 109.976 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 5.0 p -59.95 143.91 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.337 -0.852 . . . . 0.0 109.306 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.08 137.75 51.47 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.203 -0.936 . . . . 0.0 109.491 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.813 0 O-C-N 121.466 -0.772 . . . . 0.0 109.347 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.566 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.722 0 O4'-C1'-N19 110.361 3.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.566 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.757 1 O4'-C1'-N19 111.76 4.95 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.617 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.122 0 O4'-C1'-N19 110.916 3.895 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.617 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.179 0 O4'-C1'-N19 110.972 3.965 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.474 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.937 0 O4'-C1'-N19 110.664 3.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.893 0 O4'-C1'-N19 110.641 3.551 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.402 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.678 1 O4'-C1'-N19 111.268 4.335 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.402 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.78 0 O4'-C1'-N19 110.316 3.145 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.646 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.743 0 O4'-C1'-N19 110.908 3.885 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.646 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.538 1 O4'-C1'-N19 112.075 5.344 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.554 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.424 1 O4'-C1'-N19 111.177 4.221 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.554 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.845 0 O4'-C1'-N19 110.495 3.368 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.677 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.532 2.605 0 O4'-C1'-N19 110.289 3.111 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.907 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.787 1 O4'-C1'-N19 112.551 5.939 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.5 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.752 0 O4'-C1'-N19 110.949 3.936 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.45 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.53 2.42 0 O4'-C1'-N19 110.742 3.677 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? . . . . . 0 N--CA 1.498 1.943 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -30.57 71.67 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.193 -0.942 . . . . 0.0 109.172 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.51 111.17 3.98 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.375 -0.828 . . . . 0.0 109.045 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.3 -15.05 7.75 Favored Glycine 0 N--CA 1.497 2.729 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.65 HG23 ' HB2' ' A' ' 26' ' ' PRO . 5.9 m -66.56 92.6 0.21 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.217 -1.167 . . . . 0.0 109.155 179.475 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 22.3 m -84.66 131.0 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.066 -1.021 . . . . 0.0 108.27 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.539 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 17.3 t -59.02 116.42 3.8 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.288 -0.882 . . . . 0.0 110.765 -178.722 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.1 m -62.01 -12.46 18.87 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.368 -0.832 . . . . 0.0 110.83 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.697 ' OD1' HG11 ' A' ' 27' ' ' VAL . 7.8 m120 -106.8 -25.31 11.76 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.946 -1.096 . . . . 0.0 111.516 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.616 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 10.8 p -142.69 18.39 2.0 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.65 -1.281 . . . . 0.0 111.255 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 46.83 21.34 0.14 Allowed 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.405 -0.809 . . . . 0.0 112.555 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.564 HG22 ' SG ' ' A' ' 10' ' ' CYS . 7.5 t -87.14 121.83 30.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.513 -1.367 . . . . 0.0 109.849 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.29 -26.67 21.02 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.498 ' HB ' HG13 ' A' ' 51' ' ' ILE . 6.3 p -89.14 96.22 10.63 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.427 -0.796 . . . . 0.0 108.958 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.53 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 5.3 p -118.02 166.41 12.57 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.014 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.907 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 69.4 p -96.02 -38.06 10.37 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.698 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 17.0 mt -137.4 90.56 2.52 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.305 -0.872 . . . . 0.0 108.662 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.53 ' CZ2' HG23 ' A' ' 15' ' ' THR . 10.8 m95 -54.12 113.59 1.3 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.118 -0.989 . . . . 0.0 110.433 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.483 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 3.0 tpp180 -99.75 86.18 3.26 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.276 -0.89 . . . . 0.0 109.014 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.408 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.4 mmm180 -71.2 90.93 0.92 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.281 -0.887 . . . . 0.0 109.019 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.3 t -55.24 142.65 57.98 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.456 -0.777 . . . . 0.0 110.254 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -56.68 -30.89 85.68 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 C-N-CA 122.682 2.254 . . . . 0.0 110.976 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.28 -22.99 62.02 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.314 -0.866 . . . . 0.0 109.534 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.35 40.74 1.6 Allowed Glycine 0 N--CA 1.496 2.685 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -136.18 105.05 9.47 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.246 -1.15 . . . . 0.0 110.347 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.65 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.3 Cg_endo -64.98 91.96 0.2 Allowed 'Trans proline' 0 C--N 1.314 -1.283 0 C-N-CA 122.337 2.025 . . . . 0.0 109.914 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.697 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.5 m -109.99 125.61 67.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.057 -1.027 . . . . 0.0 110.573 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.502 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.6 p -49.21 133.5 19.06 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.591 -0.693 . . . . 0.0 110.189 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.698 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 4.7 t-20 -39.92 -40.16 0.96 Allowed 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.577 -0.702 . . . . 0.0 111.586 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.54 -43.27 65.08 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.113 -0.992 . . . . 0.0 110.047 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 6.5 m -64.29 -41.52 96.83 Favored 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.55 -36.55 93.36 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 178.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.476 ' HB3' ' H73' ' C' ' 123' ' ' ' DT' . 83.5 mt -73.3 -62.97 1.29 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.545 -0.974 . . . . 0.0 110.168 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.675 ' HA ' HD22 ' A' ' 37' ' ' LEU . 89.2 t80 -51.81 -34.43 40.16 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.128 -0.983 . . . . 0.0 109.141 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.469 ' O ' ' N ' ' A' ' 39' ' ' GLN . 36.0 t80 -58.0 -52.68 64.52 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.428 -0.795 . . . . 0.0 109.22 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 tttp -55.08 -31.33 61.1 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.074 -1.016 . . . . 0.0 110.433 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.675 HD22 ' HA ' ' A' ' 34' ' ' TYR . 2.2 mp -61.29 -68.11 0.34 Allowed 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.215 -0.928 . . . . 0.0 110.576 -179.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CB ' HG22 ' A' ' 40' ' ' VAL . 75.6 m-70 -96.9 10.0 40.32 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.053 -1.03 . . . . 0.0 110.412 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.491 ' HG3' ' O ' ' A' ' 38' ' ' HIS . 1.9 pt20 45.14 31.32 0.74 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.643 -0.661 . . . . 0.0 111.09 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.6 m -127.96 -170.01 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 121.351 -0.843 . . . . 0.0 109.582 179.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -60.62 178.63 0.21 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.274 -0.891 . . . . 0.0 110.558 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -131.52 106.43 14.42 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.073 -1.017 . . . . 0.0 109.915 -179.031 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -60.08 133.98 53.45 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 C-N-CA 122.387 2.058 . . . . 0.0 111.162 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.619 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -91.01 -1.6 57.79 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.288 -0.882 . . . . 0.0 110.928 -179.83 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 45' ' ' THR . 3.1 p -58.07 -16.68 13.84 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.067 -1.02 . . . . 0.0 110.903 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 18.0 ttp -94.84 -5.16 45.69 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.885 -1.134 . . . . 0.0 111.036 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.462 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -81.08 168.99 18.01 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 120.549 -1.344 . . . . 0.0 110.335 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -132.85 -174.83 3.58 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.226 -0.921 . . . . 0.0 109.735 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -77.09 -17.91 58.37 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.492 -0.755 . . . . 0.0 110.481 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.48 148.76 19.62 Favored Glycine 0 N--CA 1.5 2.944 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.508 HG21 HG22 ' A' ' 16' ' ' THR . 5.0 mt -53.33 110.44 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.311 -1.111 . . . . 0.0 110.091 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -47.03 123.19 5.04 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.831 -0.543 . . . . 0.0 109.955 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.58 156.44 42.43 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.005 -1.06 . . . . 0.0 110.51 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.38 -154.85 0.55 Allowed 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -62.98 87.05 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.045 -1.035 . . . . 0.0 108.615 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.408 ' CB ' " H4'" ' C' ' 125' ' ' ' DT' . 4.9 ptt180 -50.81 156.55 0.94 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.397 -0.814 . . . . 0.0 110.715 -178.743 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -49.48 135.77 17.48 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.628 -0.67 . . . . 0.0 109.794 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 22.0 m -63.83 177.13 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.429 -0.795 . . . . 0.0 109.783 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.4 p -78.08 126.16 30.41 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 0.0 109.978 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.497 1.896 0 O-C-N 121.504 -0.748 . . . . 0.0 109.812 179.902 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.54 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.908 0 C3'-C2'-C1' 106.982 3.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.54 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.441 1.622 1 O4'-C1'-N19 112.115 5.393 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.637 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.542 1 O4'-C1'-N19 111.344 4.43 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.637 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.653 1 O4'-C1'-N19 111.336 4.42 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.52 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.909 0 O4'-C1'-N19 110.563 3.454 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.892 0 O4'-C1'-N19 110.479 3.348 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.444 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.983 1 O4'-C1'-N19 111.002 4.003 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.444 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.068 0 C3'-C2'-C1' 107.078 3.127 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.633 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.87 0 O4'-C1'-N19 110.772 3.714 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.633 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.263 1 O4'-C1'-N19 111.682 4.853 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.433 ' C5 ' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.287 0 O4'-C1'-N19 110.875 3.843 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.5 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.093 0 O4'-C1'-N19 110.421 3.277 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.5 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.43 0 O4'-C1'-N19 110.446 3.308 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.589 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.982 1 O4'-C1'-N19 112.087 5.359 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.589 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.405 0 O4'-C1'-N19 110.391 3.238 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.498 ' C6 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.516 1 O4'-C1'-N19 111.055 4.069 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 12.8 pttt . . . . . 0 N--CA 1.499 1.988 0 CA-C-O 120.932 0.396 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -80.06 71.93 6.82 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.534 -1.354 . . . . 0.0 110.268 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.38 143.09 56.38 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.398 -0.814 . . . . 0.0 109.343 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.6 -35.48 4.98 Favored Glycine 0 N--CA 1.498 2.791 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.473 HG23 ' CB ' ' A' ' 26' ' ' PRO . 58.8 m -72.13 93.17 1.4 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.341 -1.093 . . . . 0.0 109.21 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.2 m -86.19 130.16 37.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.506 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 42.6 t -61.31 115.3 3.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.118 -0.988 . . . . 0.0 110.564 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.2 m -62.02 -12.73 20.27 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.416 -0.803 . . . . 0.0 110.864 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.449 ' ND2' HG11 ' A' ' 27' ' ' VAL . 57.2 m-20 -101.59 -30.14 11.55 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.068 -1.02 . . . . 0.0 110.989 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 14.5 p -141.51 26.06 1.98 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.625 -1.297 . . . . 0.0 111.336 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.632 ' HB2' HD22 ' A' ' 44' ' ' LEU . 12.4 mt-30 41.82 20.93 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.613 0 O-C-N 121.307 -0.871 . . . . 0.0 113.163 178.726 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.48 HG22 ' SG ' ' A' ' 10' ' ' CYS . 7.3 t -85.64 132.96 34.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.411 -1.431 . . . . 0.0 109.945 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.0 t -90.66 -30.41 17.16 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.534 -0.729 . . . . 0.0 109.313 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.5 p -89.98 131.38 35.9 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.332 -0.855 . . . . 0.0 108.861 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.493 ' C ' HD11 ' A' ' 51' ' ' ILE . 19.9 p -148.74 155.8 41.49 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.055 -1.028 . . . . 0.0 110.205 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.527 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 27.2 p -75.05 -44.86 45.28 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.016 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.511 HD11 ' N6 ' ' B' ' 106' ' ' ' DA' . 9.2 mt -144.84 114.05 7.0 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.116 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.415 ' CZ2' ' O ' ' A' ' 5' ' ' THR . 15.7 m95 -65.97 103.38 0.93 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.308 -0.87 . . . . 0.0 110.273 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.486 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 3.8 tpp180 -81.35 71.36 8.34 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.492 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.43 105.07 0.47 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.287 -0.883 . . . . 0.0 109.464 -179.595 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.419 ' OG ' ' HD2' ' A' ' 22' ' ' PRO . 0.3 OUTLIER -66.88 147.76 99.0 Favored Pre-proline 0 N--CA 1.501 2.113 0 O-C-N 121.295 -0.878 . . . . 0.0 110.193 -179.394 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.419 ' HD2' ' OG ' ' A' ' 21' ' ' SER . 6.2 Cg_exo -54.95 -38.06 93.14 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.586 2.191 . . . . 0.0 111.105 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -23.59 56.32 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.314 -0.867 . . . . 0.0 109.584 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.74 36.98 1.63 Allowed Glycine 0 N--CA 1.497 2.749 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -123.38 101.0 38.09 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.018 -1.283 . . . . 0.0 110.426 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 2.4 Cg_endo -65.05 91.4 0.2 Allowed 'Trans proline' 0 C--N 1.312 -1.364 0 C-N-CA 122.214 1.943 . . . . 0.0 110.096 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.506 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.6 m -109.24 127.48 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.249 -0.907 . . . . 0.0 110.04 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.44 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 9.2 p -51.55 134.1 29.68 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.666 -0.646 . . . . 0.0 109.622 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -39.88 -44.91 1.73 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.546 -0.722 . . . . 0.0 111.545 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.42 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -49.95 -44.17 50.46 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.475 -0.765 . . . . 0.0 110.48 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.6 m -61.59 -46.69 88.77 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.294 -0.879 . . . . 0.0 108.918 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -54.75 -38.59 64.63 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.2 mt -77.73 -60.56 2.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.422 -1.046 . . . . 0.0 109.739 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.643 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 32.9 t80 -49.52 -40.15 36.74 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.331 -0.856 . . . . 0.0 109.443 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.457 ' O ' ' N ' ' A' ' 39' ' ' GLN . 27.2 t80 -56.15 -49.37 74.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.511 -0.743 . . . . 0.0 109.44 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -32.27 69.09 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 120.869 -1.144 . . . . 0.0 110.049 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 34' ' ' TYR . 4.8 mp -60.37 -67.87 0.35 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.194 -0.941 . . . . 0.0 110.593 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.663 ' O ' HG22 ' A' ' 40' ' ' VAL . 56.3 m-70 -95.16 9.83 38.17 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.147 -0.97 . . . . 0.0 110.2 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 8.2 pt20 46.65 29.07 0.88 Allowed 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.655 -0.653 . . . . 0.0 111.29 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 38' ' ' HIS . 4.6 m -141.55 165.66 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 121.315 -0.866 . . . . 0.0 109.816 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.79 166.94 15.67 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.194 -0.941 . . . . 0.0 109.581 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.643 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 1.2 mmt180 -147.43 150.29 36.91 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.035 -1.041 . . . . 0.0 109.801 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.5 ' HD2' ' CD ' ' A' ' 42' ' ' ARG . 6.1 Cg_exo -56.54 150.25 52.97 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 C-N-CA 122.341 2.027 . . . . 0.0 110.584 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.632 HD22 ' HB2' ' A' ' 11' ' ' GLN . 1.2 pp -74.64 1.36 12.38 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.372 -0.83 . . . . 0.0 111.459 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.2 t -59.5 -14.76 14.01 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 120.817 -1.177 . . . . 0.0 110.766 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.3 ttt -72.81 -37.43 67.51 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.918 -1.114 . . . . 0.0 110.489 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.483 ' CZ ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -81.75 169.77 16.53 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.095 -1.003 . . . . 0.0 110.229 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -122.41 -169.9 1.98 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.125 -0.984 . . . . 0.0 110.229 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.72 -82.33 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.582 -0.699 . . . . 0.0 110.92 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -87.37 165.89 35.99 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.493 HD11 ' C ' ' A' ' 15' ' ' THR . 5.9 mt -54.3 136.63 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.003 -1.292 . . . . 0.0 110.109 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -66.36 138.09 57.35 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.677 -0.639 . . . . 0.0 109.825 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.85 163.63 38.97 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.093 -1.004 . . . . 0.0 109.593 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.87 -157.42 0.81 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.507 -0.745 . . . . 0.0 109.294 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -59.67 135.14 57.59 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.968 -1.082 . . . . 0.0 109.487 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.447 ' HD2' " O3'" ' C' ' 125' ' ' ' DT' . 10.0 tpp180 -55.22 140.56 38.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.596 -0.69 . . . . 0.0 110.216 -179.431 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.5 134.1 45.12 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.403 HG12 ' H ' ' A' ' 58' ' ' VAL . 0.4 OUTLIER -52.57 132.76 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.36 -0.837 . . . . 0.0 109.142 179.5 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.7 p -50.09 139.46 14.2 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.507 -0.746 . . . . 0.0 110.194 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.826 0 O-C-N 121.671 -0.643 . . . . 0.0 110.149 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.482 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.612 1.888 0 C3'-C2'-C1' 107.158 3.184 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.725 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.442 1.696 0 O4'-C1'-N19 110.788 3.735 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.77 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.146 1 O4'-C1'-N19 111.198 4.247 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.77 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.144 0 O4'-C1'-N19 110.855 3.819 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.504 H2'' ' C8 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.818 0 O4'-C1'-N19 110.581 3.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.504 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.95 0 O4'-C1'-N19 110.56 3.45 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.009 0 O4'-C1'-N19 110.966 3.958 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.981 0 O4'-C1'-N19 110.517 3.396 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.652 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.685 0 O4'-C1'-N19 110.887 3.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.652 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.476 1 O4'-C1'-N19 111.706 4.882 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.458 1 O4'-C1'-N19 111.099 4.123 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.47 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.088 0 C3'-C2'-C1' 107.096 3.14 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.557 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.695 0 O4'-C1'-N19 110.374 3.217 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.654 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.296 1 O4'-C1'-N19 112.745 6.181 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.654 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.412 0 O4'-C1'-N19 110.795 3.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.426 ' OP1' ' HB2' ' A' ' 59' ' ' SER . . . . . . . . 0 C5'--C4' 1.525 1.81 0 O4'-C1'-N19 110.596 3.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.9 tptt . . . . . 0 N--CA 1.499 1.996 0 CA-C-O 121.25 0.548 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -81.64 -26.66 34.6 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.038 -1.039 . . . . 0.0 109.528 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.79 150.16 29.0 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.167 -0.958 . . . . 0.0 108.839 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.511 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 95.74 -30.14 8.83 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.348 -1.501 . . . . 0.0 109.348 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.514 HG23 ' CB ' ' A' ' 26' ' ' PRO . 11.2 m -58.31 93.46 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.231 -1.158 . . . . 0.0 109.063 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 4' ' ' GLY . 13.7 m -85.28 140.16 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.133 -0.979 . . . . 0.0 108.794 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.705 ' HB2' HG22 ' A' ' 12' ' ' THR . 31.4 t -64.67 120.36 12.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.161 -0.962 . . . . 0.0 110.252 -179.379 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 m -63.23 -14.03 44.63 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.392 -0.817 . . . . 0.0 110.427 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -107.64 -17.18 14.16 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.996 -1.065 . . . . 0.0 111.146 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.51 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 8.4 p -154.01 24.31 0.5 Allowed 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.565 -1.335 . . . . 0.0 111.116 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 7.7 pt20 33.73 34.41 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.605 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 178.718 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.705 HG22 ' HB2' ' A' ' 7' ' ' CYS . 6.1 t -83.79 131.33 34.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.541 -1.349 . . . . 0.0 109.165 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.3 p -89.28 -1.1 57.94 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.315 -0.865 . . . . 0.0 109.18 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.5 p -128.35 132.25 48.59 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.489 -0.757 . . . . 0.0 109.241 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.528 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 5.7 p -144.9 158.77 43.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.306 -0.871 . . . . 0.0 109.543 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.636 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 48.8 p -85.95 -26.99 25.21 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.725 HD11 ' O6 ' ' B' ' 107' ' ' ' DG' . 59.9 mt -146.48 94.62 2.47 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.528 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.7 m95 -57.8 115.6 2.92 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.969 -1.082 . . . . 0.0 110.395 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.27 92.61 4.28 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.314 -0.866 . . . . 0.0 109.289 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.482 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -80.47 104.87 11.3 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.0 109.239 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.4 m -64.05 148.11 95.7 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.145 -0.972 . . . . 0.0 110.123 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -55.37 -44.92 44.13 Favored 'Trans proline' 0 C--N 1.319 -1.016 0 C-N-CA 122.771 2.314 . . . . 0.0 111.191 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 41.2 mtt -57.76 -21.54 41.96 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.236 -0.915 . . . . 0.0 110.153 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.444 ' HA2' ' NH1' ' A' ' 20' ' ' ARG . . . 111.04 45.36 0.88 Allowed Glycine 0 N--CA 1.497 2.716 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -128.34 92.68 40.54 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.572 -0.958 . . . . 0.0 110.172 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.514 ' CB ' HG23 ' A' ' 5' ' ' THR . 2.7 Cg_endo -63.47 95.63 0.18 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.08 1.854 . . . . 0.0 109.728 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.524 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.04 124.22 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.099 -1.0 . . . . 0.0 110.617 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.493 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.3 p -49.17 136.15 15.56 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.653 -0.654 . . . . 0.0 109.867 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.663 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 12.2 t-20 -40.2 -41.08 1.23 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.661 -0.65 . . . . 0.0 111.465 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.44 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -50.83 -45.81 59.74 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.372 -0.83 . . . . 0.0 110.265 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.454 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 34.6 m -67.92 -39.83 83.47 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.288 -0.882 . . . . 0.0 108.751 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.95 -39.21 95.28 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 65.0 mt -74.72 -60.74 2.14 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.415 -1.05 . . . . 0.0 109.881 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.568 ' CE1' ' HB3' ' A' ' 42' ' ' ARG . 47.3 t80 -49.22 -37.84 24.4 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.378 -0.826 . . . . 0.0 109.106 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.522 ' O ' ' N ' ' A' ' 39' ' ' GLN . 15.9 t80 -62.08 -52.88 62.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.543 -0.723 . . . . 0.0 109.659 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.42 -29.13 14.84 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.651 -1.28 . . . . 0.0 110.434 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.32 -63.39 1.07 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.027 -1.046 . . . . 0.0 110.862 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.454 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 9.7 m-70 -97.42 -32.44 11.85 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.126 -0.984 . . . . 0.0 110.214 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 81.87 26.73 0.18 Allowed 'General case' 0 N--CA 1.504 2.265 0 CA-C-O 121.699 0.761 . . . . 0.0 110.689 -179.853 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.6 m -130.63 168.18 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 O-C-N 120.857 -1.152 . . . . 0.0 109.754 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -73.32 146.82 44.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.21 -0.931 . . . . 0.0 109.18 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.568 ' HB3' ' CE1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -128.5 149.94 73.12 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.069 -1.02 . . . . 0.0 110.456 -179.346 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.423 ' O ' ' HD3' ' A' ' 42' ' ' ARG . 2.1 Cg_endo -62.33 135.67 55.28 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 C-N-CA 122.506 2.137 . . . . 0.0 111.091 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.51 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -84.54 29.54 0.59 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.367 -0.833 . . . . 0.0 111.063 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.0 t -61.21 -17.4 53.03 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.751 -1.218 . . . . 0.0 110.473 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.51 -7.53 57.48 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.899 -1.126 . . . . 0.0 110.608 179.284 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.447 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -73.34 113.52 10.51 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.61 -1.307 . . . . 0.0 109.251 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.84 -156.25 0.57 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.474 -0.767 . . . . 0.0 110.172 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -73.91 0.12 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.472 -0.768 . . . . 0.0 110.328 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -102.84 174.04 23.11 Favored Glycine 0 N--CA 1.497 2.715 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.606 HG21 HG22 ' A' ' 16' ' ' THR . 6.1 mt -59.02 135.26 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.279 -1.13 . . . . 0.0 110.005 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -69.84 161.6 29.57 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.448 -0.782 . . . . 0.0 110.133 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.51 168.75 26.42 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.38 -0.825 . . . . 0.0 109.048 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.89 -169.37 3.36 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.259 -0.9 . . . . 0.0 109.203 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -56.17 100.13 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.947 -1.096 . . . . 0.0 108.704 179.144 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -46.43 127.15 8.88 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.572 -0.705 . . . . 0.0 110.7 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -63.13 125.16 23.14 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.72 -0.612 . . . . 0.0 110.061 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.432 HG12 ' N ' ' A' ' 59' ' ' SER . 47.2 t -74.87 158.34 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.475 -0.766 . . . . 0.0 109.678 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.432 ' N ' HG12 ' A' ' 58' ' ' VAL . 48.2 t -72.75 76.58 1.12 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.155 -0.966 . . . . 0.0 109.886 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 N--CA 1.493 1.724 0 O-C-N 121.359 -0.838 . . . . 0.0 109.189 179.86 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.596 ' N7 ' HD22 ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.443 1.752 0 C3'-C2'-C1' 107.027 3.09 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.548 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.871 1 O4'-C1'-N19 111.988 5.235 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.634 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.471 1 O4'-C1'-N19 111.31 4.387 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.634 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.06 1 O4'-C1'-N19 111.122 4.153 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.537 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.704 0 O4'-C1'-N19 110.81 3.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.758 0 O4'-C1'-N19 110.504 3.38 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.865 0 O4'-C1'-N19 110.915 3.894 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.049 0 O4'-C1'-N19 110.427 3.284 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.777 ' C8 ' ' H71' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.903 1 O4'-C1'-N19 111.263 4.329 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.777 ' H71' ' C8 ' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.424 1 O4'-C1'-N19 112.287 5.608 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.417 ' C4 ' ' N3 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.527 1 O4'-C1'-N19 112.1 5.375 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.48 ' H73' ' HB3' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.526 1.877 0 O4'-C1'-N19 110.664 3.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.56 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.528 2.156 0 O4'-C1'-N19 110.606 3.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.61 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.314 1 O4'-C1'-N19 112.144 5.43 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.471 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.702 0 O4'-C1'-N19 110.946 3.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.455 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.486 1 O4'-C1'-N19 111.041 4.051 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.832 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 mmt180 -100.5 43.05 1.08 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.333 -0.855 . . . . 0.0 109.452 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.28 135.88 57.23 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.29 -0.881 . . . . 0.0 109.974 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.98 0.86 65.69 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.628 HG22 ' CH2' ' A' ' 18' ' ' TRP . 53.5 m -81.46 84.92 6.57 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.862 -1.375 . . . . 0.0 109.976 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 6' ' ' VAL . 21.9 m -85.23 114.69 25.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 178.658 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.652 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 1.7 t -42.61 113.22 0.44 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.45 -0.781 . . . . 0.0 110.932 -178.135 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' SER . . . . . 0.537 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 53.5 m -65.51 -12.58 54.09 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.134 -0.979 . . . . 0.0 111.276 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.826 ' HB2' HG12 ' A' ' 27' ' ' VAL . 4.4 m-20 -103.38 -24.84 13.46 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.955 -1.09 . . . . 0.0 110.583 179.833 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.518 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 9.2 p -144.7 25.83 1.44 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.88 -1.137 . . . . 0.0 110.767 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.812 ' HB2' HD22 ' A' ' 44' ' ' LEU . 0.0 OUTLIER 38.96 25.6 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.367 -0.833 . . . . 0.0 113.028 178.781 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' ' 7' ' ' CYS . 5.4 t -89.08 131.2 35.34 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.412 -1.43 . . . . 0.0 109.218 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.2 p -90.03 -29.82 18.15 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.493 ' HB ' ' CG1' ' A' ' 51' ' ' ILE . 2.9 p -93.79 124.8 38.03 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.419 -0.801 . . . . 0.0 109.438 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.601 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 11.9 p -134.01 140.15 46.51 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.35 -0.844 . . . . 0.0 109.244 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.61 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 70.4 p -62.14 -36.86 83.07 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 179.076 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.596 HD22 ' N7 ' ' B' ' 106' ' ' ' DA' . 13.2 mt -149.56 112.28 4.79 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.587 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.628 ' CH2' HG22 ' A' ' 5' ' ' THR . 13.8 m95 -59.58 123.44 16.9 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.495 -0.753 . . . . 0.0 110.112 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.576 ' O ' HG23 ' A' ' 27' ' ' VAL . 2.0 ttm180 -116.34 74.47 0.9 Allowed 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.73 119.5 11.31 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.939 -1.101 . . . . 0.0 109.503 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.436 ' OG ' HG22 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -86.91 142.62 34.28 Favored Pre-proline 0 N--CA 1.501 2.085 0 O-C-N 121.016 -1.053 . . . . 0.0 110.006 -179.67 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -56.27 -28.67 72.7 Favored 'Trans proline' 0 C--N 1.32 -0.946 0 C-N-CA 122.722 2.281 . . . . 0.0 110.981 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.5 mtp -55.45 -25.11 34.62 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.469 -0.77 . . . . 0.0 109.63 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.14 35.31 2.55 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.657 -1.377 . . . . 0.0 109.657 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -137.8 108.38 8.4 Favored Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 121.381 -1.07 . . . . 0.0 109.966 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.537 ' HD2' ' OG ' ' A' ' 8' ' ' SER . 2.9 Cg_endo -60.7 99.7 0.15 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 C-N-CA 121.786 1.657 . . . . 0.0 110.087 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.826 HG12 ' HB2' ' A' ' 9' ' ' ASN . 2.1 m -109.97 147.51 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.173 -0.954 . . . . 0.0 109.745 179.721 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.448 ' N ' ' SG ' ' A' ' 7' ' ' CYS . 30.4 p -83.5 153.65 24.3 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.286 -0.884 . . . . 0.0 108.656 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.513 ' OD1' HD12 ' A' ' 33' ' ' LEU . 11.2 t-20 -41.36 -42.56 2.27 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.562 -0.712 . . . . 0.0 110.079 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.67 -43.46 97.62 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.32 -0.863 . . . . 0.0 110.794 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 1.7 m -58.97 -44.21 91.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.099 -1.001 . . . . 0.0 108.924 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -68.82 -38.78 85.69 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 36.3 mt -69.5 -66.07 0.63 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.373 -1.075 . . . . 0.0 110.609 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HA ' HD13 ' A' ' 37' ' ' LEU . 80.2 t80 -49.91 -35.29 23.24 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.98 -1.075 . . . . 0.0 109.57 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.572 ' CE1' ' HG3' ' A' ' 39' ' ' GLN . 29.4 t80 -61.76 -47.7 84.0 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.338 -0.851 . . . . 0.0 109.838 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -57.51 -24.36 55.52 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 120.038 -1.664 . . . . 0.0 110.633 179.528 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.593 HD13 ' HA ' ' A' ' 34' ' ' TYR . 2.3 mp -70.78 -67.55 0.5 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.999 -1.063 . . . . 0.0 110.189 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.445 ' HB2' HG22 ' A' ' 40' ' ' VAL . 11.5 m80 -97.29 -22.12 16.85 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.198 -0.939 . . . . 0.0 110.147 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.572 ' HG3' ' CE1' ' A' ' 35' ' ' TYR . 1.1 tt0 65.27 48.75 2.08 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 121.913 0.863 . . . . 0.0 110.438 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.4 m -142.21 169.54 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 O-C-N 121.294 -0.879 . . . . 0.0 109.012 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.4 p-10 -83.92 150.57 25.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.992 -1.067 . . . . 0.0 108.852 179.299 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.498 ' HG3' ' HD2' ' A' ' 43' ' ' PRO . 64.4 ttt180 -145.08 137.99 13.83 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 120.818 -1.176 . . . . 0.0 110.236 -179.407 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.498 ' HD2' ' HG3' ' A' ' 42' ' ' ARG . 3.3 Cg_exo -59.94 151.18 73.58 Favored 'Trans proline' 0 C--N 1.317 -1.126 0 C-N-CA 122.462 2.108 . . . . 0.0 110.415 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.812 HD22 ' HB2' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -83.14 40.52 0.71 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.06 -1.025 . . . . 0.0 111.144 -179.395 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.4 p -70.78 -10.13 58.86 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.913 -1.117 . . . . 0.0 110.309 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.0 ttm -102.3 -19.42 15.02 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.035 -1.041 . . . . 0.0 110.765 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 1.9 mpt_? -81.64 175.24 10.64 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.856 -1.153 . . . . 0.0 110.171 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.7 166.09 29.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.31 -0.868 . . . . 0.0 109.696 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -58.07 -28.25 64.37 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.309 -0.869 . . . . 0.0 110.342 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -109.17 123.39 6.88 Favored Glycine 0 N--CA 1.497 2.722 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.517 HG21 HG22 ' A' ' 16' ' ' THR . 5.5 mt -53.37 136.6 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.418 -1.048 . . . . 0.0 110.075 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.81 146.27 40.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.505 -0.747 . . . . 0.0 110.001 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.25 158.82 39.44 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.117 -0.989 . . . . 0.0 109.433 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -151.31 -162.39 1.53 Allowed 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -54.13 103.63 0.09 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.841 -1.162 . . . . 0.0 108.921 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -55.73 160.99 2.32 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.55 -0.719 . . . . 0.0 110.672 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm -66.04 128.14 34.89 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.473 -0.767 . . . . 0.0 110.045 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 1.7 m -70.96 172.2 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.477 -0.764 . . . . 0.0 109.325 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.2 p -82.65 119.38 24.22 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.948 -1.095 . . . . 0.0 108.808 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 N--CA 1.497 1.9 0 O-C-N 121.107 -0.996 . . . . 0.0 109.743 -179.257 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.598 ' N7 ' HD22 ' A' ' 17' ' ' LEU . . . . . . . . 0 P--O5' 1.612 1.874 0 C3'-C2'-C1' 106.918 3.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.547 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.439 1.454 1 O4'-C1'-N19 111.878 5.097 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.632 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.213 0 O4'-C1'-N19 110.977 3.971 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.632 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.932 1 O4'-C1'-N19 111.302 4.377 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.585 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.67 0 O4'-C1'-N19 110.723 3.654 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.479 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.703 0 O4'-C1'-N19 110.925 3.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.479 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.726 1 O4'-C1'-N19 111.148 4.186 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.444 1.832 0 O4'-C1'-N19 110.552 3.441 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.683 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.523 1.543 1 O4'-C1'-N19 111.894 5.118 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.683 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.533 2.743 1 O4'-C1'-N19 111.639 4.799 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.47 ' N3 ' ' N1 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.099 1 O4'-C1'-N19 111.521 4.651 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.5 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.343 0 O4'-C1'-N19 110.627 3.534 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.623 " H2'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.532 2.587 0 O4'-C1'-N19 110.591 3.489 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.538 H2'' ' C6 ' ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.502 1 O4'-C1'-N19 112.271 5.588 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.538 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.806 0 O4'-C1'-N19 110.58 3.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.504 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.195 0 O4'-C1'-N19 110.841 3.801 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt . . . . . 0 N--CA 1.496 1.831 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -77.19 -1.51 29.8 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.265 -0.897 . . . . 0.0 110.121 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -53.05 153.83 3.3 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.036 -1.04 . . . . 0.0 109.447 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.468 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 106.21 -28.61 13.12 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 108.944 -1.662 . . . . 0.0 108.944 -178.768 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.496 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 27.8 m -60.13 92.16 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.409 -1.054 . . . . 0.0 109.524 179.302 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 6' ' ' VAL . 35.3 m -93.33 119.0 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.956 ' HB2' HG22 ' A' ' 12' ' ' THR . 9.3 t -46.8 114.93 0.92 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.454 -0.778 . . . . 0.0 110.809 -178.482 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.4 m -63.13 -14.62 50.76 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.231 -0.918 . . . . 0.0 110.03 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -98.7 -29.16 13.18 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.103 -0.998 . . . . 0.0 110.918 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.601 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 10.4 p -143.16 25.79 1.71 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.649 -1.282 . . . . 0.0 111.456 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.415 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER 37.15 35.54 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.592 -0.693 . . . . 0.0 112.76 178.866 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.956 HG22 ' HB2' ' A' ' 7' ' ' CYS . 9.5 t -88.27 138.27 31.59 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.704 -1.248 . . . . 0.0 109.464 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.3 p -101.13 -19.79 15.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.344 -0.848 . . . . 0.0 109.627 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.447 ' HB ' HG13 ' A' ' 51' ' ' ILE . 12.0 p -108.97 113.08 25.65 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.512 -0.743 . . . . 0.0 109.537 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.626 ' C ' HD11 ' A' ' 51' ' ' ILE . 4.8 p -132.83 147.41 52.3 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.212 -0.93 . . . . 0.0 110.143 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.627 HG22 HG21 ' A' ' 51' ' ' ILE . 29.9 p -73.57 -28.06 61.65 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.598 HD22 ' N7 ' ' B' ' 106' ' ' ' DA' . 18.8 mt -149.81 120.24 7.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.515 -0.741 . . . . 0.0 109.196 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.468 ' CH2' HG21 ' A' ' 15' ' ' THR . 8.5 m95 -84.68 117.97 24.11 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.427 -0.796 . . . . 0.0 109.796 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.568 ' HD2' ' HA ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -108.7 103.36 12.44 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.156 -0.965 . . . . 0.0 109.14 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.466 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 2.0 mmt180 -77.33 119.61 21.21 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.326 -0.859 . . . . 0.0 109.729 -179.495 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 55.7 m -75.33 149.75 84.57 Favored Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.334 -0.854 . . . . 0.0 110.113 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -53.66 -47.76 25.51 Favored 'Trans proline' 0 C--N 1.321 -0.9 0 C-N-CA 122.793 2.328 . . . . 0.0 111.147 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 7.6 ttt -55.71 -25.55 40.68 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.291 -0.881 . . . . 0.0 109.435 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 114.49 45.62 0.66 Allowed Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -132.11 102.98 14.24 Favored Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.288 -1.125 . . . . 0.0 111.026 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.496 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 2.5 Cg_endo -65.42 105.14 0.7 Allowed 'Trans proline' 0 C--N 1.315 -1.231 0 C-N-CA 122.323 2.015 . . . . 0.0 109.7 178.279 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.539 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -116.45 126.69 74.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.317 -0.864 . . . . 0.0 110.736 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.45 ' HB3' ' CG2' ' A' ' 12' ' ' THR . 8.1 p -49.92 139.91 12.89 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.648 -0.658 . . . . 0.0 109.787 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.568 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 18.2 t-20 -43.13 -46.71 5.95 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.357 -0.839 . . . . 0.0 112.218 -178.39 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -46.43 -45.97 18.44 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.346 -0.846 . . . . 0.0 110.615 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 9.9 m -63.23 -44.92 93.9 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.682 -0.636 . . . . 0.0 109.37 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.47 -49.36 77.94 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.419 HD13 ' H62' ' C' ' 124' ' ' ' DA' . 42.2 mt -67.04 -60.6 2.49 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.473 -1.016 . . . . 0.0 109.938 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.487 ' HB2' ' OP2' ' C' ' 123' ' ' ' DT' . 50.6 t80 -51.41 -43.24 61.93 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.567 -0.708 . . . . 0.0 109.619 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.531 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 47.6 t80 -53.38 -47.33 69.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.411 -0.806 . . . . 0.0 108.866 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -43.09 99.58 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.057 -1.027 . . . . 0.0 110.358 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 9.6 mp -40.86 -56.62 2.17 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 121.506 -0.747 . . . . 0.0 110.705 -179.175 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.479 ' HB2' HG22 ' A' ' 40' ' ' VAL . 41.2 m-70 -115.1 6.46 15.17 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.171 -0.956 . . . . 0.0 110.288 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 35' ' ' TYR . 1.7 tm0? 49.36 34.71 6.77 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.397 -0.815 . . . . 0.0 110.13 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.479 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.7 m -141.05 167.14 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 O-C-N 121.121 -0.987 . . . . 0.0 110.17 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -84.53 156.35 21.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.505 -0.747 . . . . 0.0 109.747 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.508 ' CG ' ' HD2' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -151.08 152.07 30.7 Favored Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.296 -0.878 . . . . 0.0 109.545 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.508 ' HD2' ' CG ' ' A' ' 42' ' ' ARG . 4.6 Cg_exo -55.41 143.78 75.63 Favored 'Trans proline' 0 C--N 1.316 -1.174 0 C-N-CA 122.313 2.009 . . . . 0.0 111.147 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.601 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -95.46 37.71 1.18 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.464 -0.773 . . . . 0.0 110.561 -179.582 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -70.57 -6.64 37.97 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.946 -1.096 . . . . 0.0 110.038 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 38.1 mtp -92.15 -16.0 26.89 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.979 -1.075 . . . . 0.0 110.303 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.58 ' HG2' ' HB2' ' A' ' 44' ' ' LEU . 25.3 mmm180 -56.43 151.28 13.49 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.728 -1.232 . . . . 0.0 109.591 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -139.53 155.35 47.57 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.447 -0.783 . . . . 0.0 109.871 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -49.67 -77.59 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.616 -0.678 . . . . 0.0 110.49 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -83.4 148.4 25.16 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.627 HG21 HG22 ' A' ' 16' ' ' THR . 10.1 mt -54.25 136.89 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.324 -1.104 . . . . 0.0 109.773 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.505 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -75.48 156.0 35.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.552 -0.718 . . . . 0.0 109.836 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.446 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.99 163.01 40.24 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.439 -0.788 . . . . 0.0 109.045 178.835 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.423 ' HA ' ' HD3' ' A' ' 54' ' ' ARG . 15.6 mmt180 -147.67 -165.81 2.36 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -57.35 111.0 0.95 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.823 -1.173 . . . . 0.0 108.863 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -46.21 128.3 9.48 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.332 -0.855 . . . . 0.0 111.111 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt -63.01 117.58 6.64 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.637 -0.664 . . . . 0.0 109.322 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.4 m -71.14 178.4 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.447 -0.783 . . . . 0.0 109.868 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.0 t -83.48 139.56 32.85 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.028 -1.045 . . . . 0.0 109.717 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.796 0 O-C-N 121.527 -0.733 . . . . 0.0 110.304 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.586 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.524 1.656 0 O4'-C1'-N19 110.427 3.284 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.586 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.44 1.529 1 O4'-C1'-N19 111.403 4.504 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.539 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.123 0 O4'-C1'-N19 110.783 3.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.54 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 P--O5' 1.611 1.767 1 O4'-C1'-N19 111.002 4.002 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.54 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.836 0 O4'-C1'-N19 110.868 3.835 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.446 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.868 0 C3'-C2'-C1' 107.106 3.147 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.901 0 O4'-C1'-N19 110.992 3.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.154 0 O4'-C1'-N19 110.589 3.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.81 ' C8 ' ' H71' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.441 1.644 1 O4'-C1'-N19 111.139 4.174 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.81 ' H71' ' C8 ' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.322 1 O4'-C1'-N19 112.061 5.326 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.442 ' C4 ' ' N3 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.496 1 O4'-C1'-N19 111.705 4.881 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.288 0 O4'-C1'-N19 110.303 3.128 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.612 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.507 0 O4'-C1'-N19 110.224 3.03 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.843 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.526 1.849 1 O4'-C1'-N19 112.333 5.666 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.562 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.114 0 O4'-C1'-N19 110.641 3.551 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.493 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.508 1 O4'-C1'-N19 111.015 4.018 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.965 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.39 29.92 1.84 Allowed 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.27 -0.894 . . . . 0.0 109.712 179.514 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.92 130.54 47.5 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.235 -0.915 . . . . 0.0 109.303 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.91 -37.9 2.08 Favored Glycine 0 N--CA 1.495 2.625 0 N-CA-C 108.909 -1.676 . . . . 0.0 108.909 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.417 ' O ' ' CH2' ' A' ' 18' ' ' TRP . 65.8 m -66.53 89.08 0.14 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.362 -1.081 . . . . 0.0 109.264 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 6' ' ' VAL . 28.7 m -85.15 109.72 18.48 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.523 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 53.9 t -45.17 113.55 0.59 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.338 -0.851 . . . . 0.0 110.266 -178.778 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.4 m -63.23 -6.78 4.81 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.366 -0.833 . . . . 0.0 111.285 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.412 ' CG ' HG11 ' A' ' 27' ' ' VAL . 1.6 m120 -102.9 -31.01 10.47 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.795 -1.19 . . . . 0.0 110.728 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.623 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 17.7 p -138.19 18.84 2.78 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.812 -1.18 . . . . 0.0 111.003 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.82 25.51 0.46 Allowed 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.351 -0.843 . . . . 0.0 111.615 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.426 HG22 ' CB ' ' A' ' 7' ' ' CYS . 5.8 t -88.6 132.53 34.5 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.67 -1.268 . . . . 0.0 109.525 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 p -92.68 -6.66 48.77 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.592 -0.693 . . . . 0.0 109.25 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.0 p -112.69 128.86 56.52 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.33 -0.856 . . . . 0.0 109.686 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.547 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 5.4 p -149.07 152.56 36.42 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.059 -1.025 . . . . 0.0 109.883 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.843 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 19.5 p -83.65 -31.06 26.38 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.6 -0.687 . . . . 0.0 109.461 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.669 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 24.9 mt -141.48 87.4 2.07 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.392 -0.818 . . . . 0.0 108.873 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.547 ' CZ2' HG23 ' A' ' 15' ' ' THR . 11.5 m95 -53.32 103.14 0.07 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.247 -0.908 . . . . 0.0 110.357 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.504 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 2.3 tpt180 -88.61 83.94 6.75 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.35 -0.844 . . . . 0.0 109.259 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.8 tpp180 -71.44 114.64 9.72 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.299 -0.876 . . . . 0.0 108.903 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 26.4 p -84.01 139.6 39.85 Favored Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.178 -0.951 . . . . 0.0 109.573 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -55.86 -31.79 82.51 Favored 'Trans proline' 0 C--N 1.319 -1.011 0 C-N-CA 122.589 2.193 . . . . 0.0 111.053 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -23.81 44.88 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.436 -0.79 . . . . 0.0 109.343 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.11 28.19 3.95 Favored Glycine 0 N--CA 1.496 2.664 0 N-CA-C 109.994 -1.242 . . . . 0.0 109.994 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -129.47 99.79 20.65 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.052 -1.263 . . . . 0.0 110.14 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.472 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 Cg_endo -66.09 108.04 1.25 Allowed 'Trans proline' 0 C--N 1.314 -1.278 0 C-N-CA 122.216 1.944 . . . . 0.0 109.818 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.523 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.8 m -121.12 125.9 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.109 -0.994 . . . . 0.0 110.351 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.534 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.9 p -51.4 131.84 29.04 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.56 -0.713 . . . . 0.0 109.514 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.669 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 6.0 t-20 -41.97 -40.37 2.17 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.486 -0.759 . . . . 0.0 111.725 -178.287 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.35 -38.43 53.14 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.113 -0.992 . . . . 0.0 109.79 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.57 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 2.3 m -68.06 -42.22 80.8 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.65 -57.04 17.92 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 30.4 mt -59.71 -42.88 94.06 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.512 -0.993 . . . . 0.0 109.006 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -57.95 -42.58 85.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.353 -0.842 . . . . 0.0 109.268 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.569 ' HB2' ' NE ' ' A' ' 42' ' ' ARG . 41.4 t80 -55.79 -36.3 67.24 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.305 -0.872 . . . . 0.0 110.169 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -79.29 -49.93 11.69 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.75 -1.219 . . . . 0.0 110.092 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -49.34 -33.01 12.4 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.326 -0.859 . . . . 0.0 110.219 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.524 ' CB ' HG22 ' A' ' 40' ' ' VAL . 15.2 m80 -118.3 -6.18 10.82 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.137 -0.977 . . . . 0.0 110.64 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.47 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.4 OUTLIER 50.07 34.88 8.9 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.096 -1.002 . . . . 0.0 109.937 -179.295 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.524 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.4 m -138.71 -169.11 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 O-C-N 121.271 -0.893 . . . . 0.0 109.383 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -176.02 0.05 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.27 -0.894 . . . . 0.0 109.771 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.57 ' HG2' ' O ' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -135.63 86.26 28.87 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.011 -1.056 . . . . 0.0 110.047 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -64.79 147.26 89.52 Favored 'Trans proline' 0 C--N 1.314 -1.279 0 C-N-CA 122.367 2.045 . . . . 0.0 110.46 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.635 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.7 OUTLIER -91.34 12.78 19.32 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.093 -1.004 . . . . 0.0 110.523 179.661 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 p -53.96 -26.12 24.14 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 120.955 -1.091 . . . . 0.0 110.611 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 8.1 ttp -94.61 -6.65 43.0 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.197 -0.939 . . . . 0.0 110.845 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.481 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -81.47 162.4 23.29 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.931 -1.105 . . . . 0.0 110.395 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.534 ' HD2' ' HG3' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -146.18 -173.56 4.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.525 -0.734 . . . . 0.0 109.118 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.71 -9.05 58.18 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.383 -0.823 . . . . 0.0 111.598 -179.315 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -141.53 149.74 21.34 Favored Glycine 0 N--CA 1.501 3.026 0 O-C-N 120.53 -1.356 . . . . 0.0 110.727 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.601 HG21 HG22 ' A' ' 16' ' ' THR . 4.7 mt -63.6 131.76 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.379 -1.071 . . . . 0.0 109.567 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.534 ' HG3' ' HD2' ' A' ' 48' ' ' LYS . 3.6 mt-30 -63.73 136.85 57.77 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.335 -0.853 . . . . 0.0 110.145 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.61 160.67 40.63 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.102 -0.999 . . . . 0.0 109.853 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.51 -155.67 0.63 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -56.39 114.96 2.22 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.835 -1.165 . . . . 0.0 108.503 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.645 ' HD3' " O3'" ' C' ' 125' ' ' ' DT' . 5.3 ttm180 -51.78 143.13 13.59 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.508 -0.745 . . . . 0.0 110.773 -178.757 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -58.22 143.33 44.67 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.503 -0.748 . . . . 0.0 109.529 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.4 p -50.43 116.25 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 N-CA-C 108.847 -0.798 . . . . 0.0 108.847 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.37 104.38 0.11 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.438 -0.788 . . . . 0.0 109.715 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.497 1.92 0 O-C-N 121.503 -0.748 . . . . 0.0 110.022 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.54 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.02 0 C3'-C2'-C1' 106.974 3.053 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.54 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.945 1 O4'-C1'-N19 112.116 5.395 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.634 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.451 1 O4'-C1'-N19 111.22 4.276 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.634 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.001 1 O4'-C1'-N19 111.2 4.25 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.537 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.79 0 O4'-C1'-N19 110.585 3.481 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C1'-N19 110.542 3.428 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.429 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.44 1.556 1 O4'-C1'-N19 111.219 4.273 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.429 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.782 0 O4'-C1'-N19 110.452 3.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.577 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.808 0 O4'-C1'-N19 110.599 3.499 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.577 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.579 1 O4'-C1'-N19 111.634 4.793 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.421 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.49 0 O4'-C1'-N19 110.931 3.914 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.442 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.3 0 O4'-C1'-N19 110.845 3.806 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.615 " H2'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.708 1 O4'-C1'-N19 111.053 4.066 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.58 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.529 2.312 1 O4'-C1'-N19 111.815 5.018 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.503 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.465 0 O4'-C1'-N19 110.69 3.613 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.447 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.481 0 O4'-C1'-N19 110.579 3.474 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.799 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.09 66.76 9.48 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.176 -0.953 . . . . 0.0 109.018 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.22 146.56 43.18 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.326 -0.859 . . . . 0.0 109.544 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.27 -31.93 8.16 Favored Glycine 0 N--CA 1.495 2.584 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.503 HG23 ' CB ' ' A' ' 26' ' ' PRO . 55.1 m -66.59 93.97 0.27 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.284 -1.127 . . . . 0.0 109.917 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.6 m -100.14 138.73 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.935 ' HB2' HG22 ' A' ' 12' ' ' THR . 12.2 t -58.18 118.79 5.85 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.256 -0.902 . . . . 0.0 110.478 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.2 m -64.11 -12.75 42.36 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.245 -0.909 . . . . 0.0 110.153 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -105.04 -25.46 12.53 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.183 -0.948 . . . . 0.0 110.855 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.567 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 7.5 p -147.9 28.05 0.95 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.657 -1.277 . . . . 0.0 111.12 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 30.69 40.56 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.688 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 178.676 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.935 HG22 ' HB2' ' A' ' 7' ' ' CYS . 12.2 t -90.44 139.7 30.43 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.976 -1.077 . . . . 0.0 108.96 178.833 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -99.0 -24.97 14.72 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.946 -1.096 . . . . 0.0 109.493 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.8 p -101.25 116.06 31.93 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.494 -0.754 . . . . 0.0 109.232 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.425 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 6.2 p -138.49 154.93 48.82 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.028 -1.045 . . . . 0.0 110.037 -179.597 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.615 HG21 " H2'" ' C' ' 124' ' ' ' DA' . 40.9 p -74.87 -31.33 61.59 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.149 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.519 ' HA ' HD23 ' A' ' 17' ' ' LEU . 8.8 mt -153.94 125.01 7.32 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -82.04 106.51 14.01 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.628 -0.67 . . . . 0.0 109.979 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.546 ' HB2' ' O ' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -80.91 77.45 7.79 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.071 -1.018 . . . . 0.0 108.985 179.43 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 18.3 tpt180 -61.29 99.62 0.11 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.559 ' HB3' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -60.21 152.03 64.61 Favored Pre-proline 0 N--CA 1.5 2.026 0 O-C-N 121.395 -0.816 . . . . 0.0 109.545 -179.421 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -54.17 -44.21 51.4 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 C-N-CA 122.645 2.23 . . . . 0.0 110.809 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -19.08 64.95 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.255 -0.903 . . . . 0.0 109.731 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.02 41.63 1.16 Allowed Glycine 0 N--CA 1.496 2.678 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.559 ' HB2' ' HB3' ' A' ' 21' ' ' SER . 51.1 m-20 -120.02 96.25 49.32 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.274 -1.133 . . . . 0.0 110.196 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.503 ' CB ' HG23 ' A' ' 5' ' ' THR . 1.3 Cg_endo -68.22 96.44 0.47 Allowed 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.155 1.904 . . . . 0.0 109.838 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.546 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 2.0 m -111.45 122.71 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.064 -1.022 . . . . 0.0 110.549 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.425 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 4.2 p -45.51 129.87 8.63 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.5 -0.75 . . . . 0.0 110.125 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -32.35 -51.37 0.26 Allowed 'General case' 0 N--CA 1.507 2.424 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.245 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.54 -47.85 27.84 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.313 -0.867 . . . . 0.0 111.128 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 14.8 m -60.05 -45.79 91.67 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.381 -0.824 . . . . 0.0 108.87 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.85 -50.17 70.59 Favored Glycine 0 N--CA 1.493 2.463 0 N-CA-C 110.229 -1.148 . . . . 0.0 110.229 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.424 HD13 ' C7 ' ' C' ' 123' ' ' ' DT' . 90.7 mt -63.9 -62.11 1.85 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.369 -1.077 . . . . 0.0 110.359 -179.448 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.556 ' CD1' ' HB2' ' A' ' 42' ' ' ARG . 21.0 t80 -51.67 -44.15 62.96 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.317 -0.864 . . . . 0.0 109.177 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.475 ' O ' ' N ' ' A' ' 39' ' ' GLN . 23.4 t80 -50.81 -48.48 59.72 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.573 -0.705 . . . . 0.0 109.41 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.22 -37.98 88.98 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.043 -1.035 . . . . 0.0 110.657 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 34' ' ' TYR . 7.5 mp -46.19 -53.97 9.56 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.05 -1.031 . . . . 0.0 110.008 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.524 ' CB ' HG22 ' A' ' 40' ' ' VAL . 88.1 m-70 -112.05 10.15 20.38 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.268 -0.895 . . . . 0.0 109.73 179.045 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.475 ' N ' ' O ' ' A' ' 35' ' ' TYR . 2.5 tt0 47.62 35.12 4.1 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.4 -0.813 . . . . 0.0 110.136 -178.679 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.524 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.7 m -132.94 -177.9 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 O-C-N 121.517 -0.74 . . . . 0.0 109.385 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -75.59 179.47 5.32 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.278 -0.889 . . . . 0.0 110.661 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.556 ' HB2' ' CD1' ' A' ' 34' ' ' TYR . 10.0 ttp180 -150.19 132.62 8.08 Favored Pre-proline 0 N--CA 1.498 1.957 0 O-C-N 121.198 -0.939 . . . . 0.0 109.787 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.421 ' HD2' ' HG2' ' A' ' 42' ' ' ARG . 1.2 Cg_endo -63.79 149.36 90.92 Favored 'Trans proline' 0 C--N 1.316 -1.154 0 C-N-CA 122.155 1.904 . . . . 0.0 110.657 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.567 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 1.1 pp -85.98 -1.47 57.36 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.02 -1.05 . . . . 0.0 110.245 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 t -61.3 -11.39 9.61 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.119 -0.988 . . . . 0.0 110.856 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.19 -7.36 48.54 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.782 -1.198 . . . . 0.0 110.694 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.595 ' HD3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -74.18 172.92 10.89 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.556 -1.34 . . . . 0.0 110.253 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.403 ' HG3' ' N ' ' A' ' 49' ' ' ASP . 1.9 tppp? -136.61 163.98 29.29 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.25 -0.906 . . . . 0.0 109.3 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.403 ' N ' ' HG3' ' A' ' 48' ' ' LYS . 6.4 t70 -49.09 -80.46 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.478 -0.764 . . . . 0.0 110.351 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.85 161.96 26.1 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.492 ' CG2' HG22 ' A' ' 16' ' ' THR . 5.4 mt -57.06 126.58 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.291 -1.123 . . . . 0.0 109.737 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.446 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -69.15 154.23 42.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.498 -0.751 . . . . 0.0 109.58 179.749 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.438 ' HB ' ' OP1' ' C' ' 125' ' ' ' DT' . 0.0 OUTLIER -156.19 162.41 40.19 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.166 -0.959 . . . . 0.0 109.515 179.016 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.405 ' HD2' ' HA ' ' A' ' 54' ' ' ARG . 5.6 mmm180 -150.88 -172.61 4.25 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.54 -0.725 . . . . 0.0 110.421 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.19 79.53 0.97 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.13 -0.981 . . . . 0.0 109.562 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.47 ' HD2' " O3'" ' C' ' 125' ' ' ' DT' . 0.0 OUTLIER -58.58 162.2 4.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.604 -0.685 . . . . 0.0 110.41 -179.689 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.8 pttt -57.54 164.5 1.94 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.442 -0.786 . . . . 0.0 109.919 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 6.2 m -68.65 162.57 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.015 -1.053 . . . . 0.0 109.714 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 m -81.31 90.38 6.13 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.169 -0.957 . . . . 0.0 108.711 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.499 2.007 0 O-C-N 121.55 -0.719 . . . . 0.0 110.253 -179.053 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.529 ' C6 ' ' C6 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.688 0 O4'-C1'-N19 110.556 3.444 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.662 ' O6 ' HD13 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.526 1.821 1 O4'-C1'-N19 111.243 4.303 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.609 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.292 1 O4'-C1'-N19 111.231 4.289 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.609 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.285 0 O4'-C1'-N19 110.953 3.942 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.502 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.693 0 O4'-C1'-N19 110.499 3.374 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.438 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.441 1.614 0 O4'-C1'-N19 110.659 3.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.438 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.707 0 O4'-C1'-N19 110.89 3.862 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.418 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.879 0 O4'-C1'-N19 110.461 3.327 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.704 ' C8 ' ' H71' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 P--O5' 1.61 1.668 1 O4'-C1'-N19 111.326 4.407 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.704 ' H71' ' C8 ' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.625 1 O4'-C1'-N19 112.032 5.29 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.42 ' C5 ' ' C2 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.766 1 O4'-C1'-N19 112.106 5.382 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.537 ' H71' ' HB3' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.531 2.509 0 O4'-C1'-N19 110.416 3.27 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.623 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.535 2.974 0 O4'-C1'-N19 110.82 3.775 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.608 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.204 1 O4'-C1'-N19 112.331 5.664 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.608 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.535 0 O4'-C1'-N19 110.766 3.708 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.463 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.53 2.408 0 O4'-C1'-N19 110.991 3.988 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.037 0 CA-C-O 120.49 0.186 . . . . 0.0 110.562 . . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.43 -31.3 14.7 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.052 -1.03 . . . . 0.0 110.036 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -57.66 119.93 7.46 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.257 -0.902 . . . . 0.0 108.954 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.484 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 130.38 -26.67 4.1 Favored Glycine 0 N--CA 1.495 2.624 0 N-CA-C 109.275 -1.53 . . . . 0.0 109.275 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.541 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 98.5 m -59.46 91.7 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.277 -1.131 . . . . 0.0 109.349 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 6' ' ' VAL . 21.0 m -83.91 111.0 19.26 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.049 -1.032 . . . . 0.0 108.261 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.487 ' CB ' HG22 ' A' ' 12' ' ' THR . 40.8 t -48.24 109.5 0.24 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.438 -0.789 . . . . 0.0 110.158 -178.733 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.6 m -58.29 -12.15 3.42 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.43 -0.794 . . . . 0.0 111.368 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.477 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.9 OUTLIER -96.16 -30.67 13.38 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.965 -1.084 . . . . 0.0 110.793 -179.68 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.594 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 17.4 p -141.03 19.3 2.28 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.661 -1.274 . . . . 0.0 111.41 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.3 tp-100 47.5 25.61 0.66 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.321 -0.862 . . . . 0.0 111.768 179.199 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.487 HG22 ' CB ' ' A' ' 7' ' ' CYS . 8.1 t -87.49 132.96 33.84 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.81 -1.181 . . . . 0.0 109.816 179.36 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 94.8 p -90.24 -23.15 21.32 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.3 p -98.99 130.91 45.36 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.61 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 12.9 p -148.82 138.44 21.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.271 -0.893 . . . . 0.0 109.646 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.623 HG21 " H3'" ' C' ' 124' ' ' ' DA' . 2.5 p -64.15 -34.87 79.05 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.662 HD13 ' O6 ' ' B' ' 107' ' ' ' DG' . 46.7 mt -144.48 104.78 4.1 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 121.401 0.62 . . . . 0.0 109.5 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.61 ' CZ3' HG21 ' A' ' 15' ' ' THR . 6.5 m95 -62.56 99.93 0.17 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.191 -0.943 . . . . 0.0 109.85 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -83.94 82.08 8.5 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.395 -0.815 . . . . 0.0 108.954 179.568 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.443 ' NH1' ' HG3' ' A' ' 26' ' ' PRO . 4.1 tpp180 -63.06 96.14 0.09 Allowed 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -58.81 133.6 86.64 Favored Pre-proline 0 N--CA 1.495 1.798 0 O-C-N 121.385 -0.822 . . . . 0.0 110.289 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -56.4 -33.08 91.0 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 C-N-CA 122.517 2.145 . . . . 0.0 110.556 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -23.91 31.58 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.386 -0.821 . . . . 0.0 109.767 178.834 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.49 26.95 3.24 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -132.63 112.39 13.86 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 120.959 -1.318 . . . . 0.0 110.408 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.541 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 1.1 Cg_endo -67.95 105.95 1.24 Allowed 'Trans proline' 0 C--N 1.313 -1.321 0 C-N-CA 122.09 1.86 . . . . 0.0 109.474 178.442 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.478 ' O ' ' HB3' ' A' ' 19' ' ' ARG . 2.1 m -121.56 127.27 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.086 -1.009 . . . . 0.0 110.246 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.494 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.4 p -48.98 132.28 18.71 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.457 -0.777 . . . . 0.0 109.09 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.61 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.8 t-20 -35.7 -48.09 0.52 Allowed 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.685 -0.634 . . . . 0.0 111.761 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -45.42 -51.67 11.1 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.346 -0.847 . . . . 0.0 110.9 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 32.8 m -61.28 -47.99 83.44 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.395 -0.816 . . . . 0.0 109.243 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.07 -33.56 75.06 Favored Glycine 0 N--CA 1.497 2.75 0 N-CA-C 110.841 -0.903 . . . . 0.0 110.841 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.537 ' HB3' ' H71' ' C' ' 123' ' ' ' DT' . 68.0 mt -74.16 -62.45 1.51 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.252 -1.146 . . . . 0.0 110.19 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.634 ' HA ' HD22 ' A' ' 37' ' ' LEU . 25.0 t80 -55.52 -40.66 72.07 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.102 -0.999 . . . . 0.0 108.917 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.467 ' O ' ' N ' ' A' ' 39' ' ' GLN . 40.9 t80 -54.89 -46.13 74.77 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 0.0 109.675 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -61.36 -32.85 72.76 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.761 -1.212 . . . . 0.0 110.3 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.634 HD22 ' HA ' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -57.95 -62.13 2.03 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.214 -0.928 . . . . 0.0 110.863 -179.338 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.499 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 61.5 m80 -105.0 9.8 34.34 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.011 -1.056 . . . . 0.0 110.364 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.3 OUTLIER 50.05 27.47 2.51 Favored 'General case' 0 N--CA 1.505 2.303 0 CA-C-O 121.589 0.709 . . . . 0.0 110.685 -179.117 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' CB ' ' A' ' 38' ' ' HIS . 6.2 m -130.94 160.95 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 O-C-N 121.237 -0.914 . . . . 0.0 110.19 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -79.87 162.49 24.99 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.371 0.605 . . . . 0.0 110.101 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.487 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -145.98 150.49 42.51 Favored Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.298 -0.876 . . . . 0.0 109.954 179.509 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -59.11 146.77 93.27 Favored 'Trans proline' 0 C--N 1.315 -1.213 0 C-N-CA 122.534 2.156 . . . . 0.0 111.031 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.594 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -83.93 37.21 0.59 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.297 -0.877 . . . . 0.0 110.865 -179.866 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.0 p -68.14 -8.38 38.02 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.007 -1.058 . . . . 0.0 110.293 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.3 mmm -93.0 -20.26 20.76 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.11 -0.994 . . . . 0.0 110.304 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.548 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -66.77 142.68 57.29 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.88 -1.137 . . . . 0.0 109.614 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -131.59 -155.42 0.69 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.35 -0.844 . . . . 0.0 109.53 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.15 -84.85 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.453 -0.779 . . . . 0.0 110.644 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -110.52 170.45 14.02 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.281 -1.527 . . . . 0.0 109.281 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.565 ' CG2' HG23 ' A' ' 16' ' ' THR . 5.3 mt -52.6 130.15 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.259 -1.142 . . . . 0.0 110.256 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.48 165.69 24.78 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.496 0.665 . . . . 0.0 109.545 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.88 166.52 29.29 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.292 -0.88 . . . . 0.0 109.287 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.67 -168.05 3.0 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.509 -0.744 . . . . 0.0 109.749 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.72 113.02 11.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.103 -0.998 . . . . 0.0 108.835 179.365 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.486 ' HD3' ' OP1' ' C' ' 126' ' ' ' DC' . 2.7 ttp180 -51.43 151.69 2.94 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.451 -0.781 . . . . 0.0 109.964 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.453 ' N ' ' HG3' ' A' ' 56' ' ' ARG . 0.1 OUTLIER -79.96 136.45 36.63 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.379 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 6.4 p -51.66 146.04 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.307 -0.871 . . . . 0.0 108.901 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.8 p -48.29 100.51 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.178 -0.951 . . . . 0.0 109.472 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.501 2.088 0 O-C-N 121.755 -0.591 . . . . 0.0 110.74 -178.636 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.579 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.79 0 O4'-C1'-N19 110.44 3.3 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.579 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.778 1 O4'-C1'-N19 111.763 4.954 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.554 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.091 1 O4'-C1'-N19 111.238 4.298 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.564 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.052 1 O4'-C1'-N19 111.051 4.064 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.564 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.612 1.873 0 O4'-C1'-N19 110.655 3.568 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.787 0 O4'-C1'-N19 110.461 3.326 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.425 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.558 1 O4'-C1'-N19 111.118 4.148 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.425 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.442 1.694 0 O4'-C1'-N19 110.351 3.189 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.564 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.808 0 O4'-C1'-N19 110.669 3.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.564 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.401 1 O4'-C1'-N19 111.734 4.918 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.481 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.453 0 O4'-C1'-N19 110.977 3.971 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.568 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.143 0 O4'-C1'-N19 110.814 3.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.568 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.321 0 O4'-C1'-N19 110.656 3.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.593 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.524 1.663 1 O4'-C1'-N19 112.207 5.509 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.591 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.93 0 O4'-C1'-N19 110.662 3.577 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.478 ' C6 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.135 1 O4'-C1'-N19 111.064 4.08 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.8 ttpp . . . . . 0 N--CA 1.497 1.889 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -85.76 54.01 2.98 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.867 -1.146 . . . . 0.0 110.052 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.08 157.59 12.72 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.143 -0.973 . . . . 0.0 109.291 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 101.07 -46.66 1.28 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 108.635 -1.786 . . . . 0.0 108.635 -178.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.476 HG22 ' CH2' ' A' ' 18' ' ' TRP . 53.1 m -83.13 93.38 7.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.137 -1.213 . . . . 0.0 108.844 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.6 m -98.21 121.13 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.521 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 46.5 t -50.22 113.56 0.9 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.374 -0.829 . . . . 0.0 110.151 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.6 m -62.95 -11.84 21.44 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.139 -0.976 . . . . 0.0 111.112 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.478 ' OD1' HG11 ' A' ' 27' ' ' VAL . 6.5 m-20 -95.53 -31.68 13.21 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.911 -1.118 . . . . 0.0 110.747 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.517 ' SG ' HG22 ' A' ' 12' ' ' THR . 16.4 p -139.5 18.33 2.55 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.781 -1.199 . . . . 0.0 110.946 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.441 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 48.18 24.93 0.73 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.269 -0.894 . . . . 0.0 112.246 178.815 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.517 HG22 ' SG ' ' A' ' 10' ' ' CYS . 14.6 t -87.35 135.18 33.42 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.602 -1.312 . . . . 0.0 110.061 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.4 p -90.13 -16.14 30.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.487 -0.758 . . . . 0.0 109.145 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 44.9 p -102.92 129.56 49.68 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.289 -0.882 . . . . 0.0 108.713 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.564 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 7.0 p -146.36 148.76 32.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.204 -0.935 . . . . 0.0 110.092 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.593 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 32.8 p -72.03 -37.25 69.78 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.487 ' HA ' HD23 ' A' ' 17' ' ' LEU . 10.3 mt -147.07 105.55 3.8 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.564 ' CZ3' HG21 ' A' ' 15' ' ' THR . 11.4 m95 -59.51 98.62 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.466 -0.771 . . . . 0.0 110.306 -179.146 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.67 75.91 3.34 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.326 -0.859 . . . . 0.0 108.784 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.415 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.08 94.75 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.4 139.97 96.52 Favored Pre-proline 0 N--CA 1.499 1.992 0 O-C-N 121.44 -0.788 . . . . 0.0 110.429 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -53.98 -39.15 86.18 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 C-N-CA 122.832 2.355 . . . . 0.0 111.184 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -22.43 48.44 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.273 -0.892 . . . . 0.0 109.69 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.77 32.81 2.57 Favored Glycine 0 N--CA 1.498 2.77 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -128.04 98.13 27.79 Favored Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.167 -1.196 . . . . 0.0 110.076 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.521 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.1 Cg_endo -65.08 112.88 2.18 Favored 'Trans proline' 0 C--N 1.312 -1.381 0 C-N-CA 122.26 1.973 . . . . 0.0 110.191 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.478 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.2 m -124.28 131.2 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.151 -0.968 . . . . 0.0 109.953 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.497 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 6.1 p -53.67 134.73 41.62 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.43 0.633 . . . . 0.0 109.763 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -36.87 -44.73 0.51 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.724 -0.61 . . . . 0.0 112.075 -178.455 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.79 -47.81 59.64 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.331 -0.855 . . . . 0.0 110.187 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 55.9 m -68.36 -39.51 81.79 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.143 -0.973 . . . . 0.0 109.116 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.07 -36.91 69.25 Favored Glycine 0 N--CA 1.497 2.751 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 61.8 mt -80.17 -58.29 3.22 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.312 -1.11 . . . . 0.0 110.107 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.579 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 23.6 t80 -51.61 -36.69 46.75 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.541 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 17.9 t80 -59.79 -51.7 68.61 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.312 -0.867 . . . . 0.0 109.56 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -52.75 -26.15 13.3 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.664 -1.273 . . . . 0.0 110.353 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.4 mp -72.45 -66.33 0.67 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.961 -1.087 . . . . 0.0 110.381 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.45 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 77.5 m-70 -94.6 -26.57 16.31 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.992 -1.067 . . . . 0.0 110.797 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.541 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 75.56 25.53 1.21 Allowed 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 121.588 0.709 . . . . 0.0 111.374 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -124.63 167.02 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 120.941 -1.099 . . . . 0.0 110.431 179.049 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.6 p-10 -85.66 131.13 34.4 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.333 -0.854 . . . . 0.0 109.417 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.579 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 25.3 mmt180 -109.16 149.13 39.29 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.088 -1.008 . . . . 0.0 110.325 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.07 150.9 84.78 Favored 'Trans proline' 0 C--N 1.314 -1.263 0 C-N-CA 122.372 2.048 . . . . 0.0 110.431 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.617 HD13 ' CZ ' ' A' ' 47' ' ' ARG . 0.7 OUTLIER -74.33 29.83 0.08 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.187 -0.946 . . . . 0.0 111.231 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.7 p -67.97 -17.97 64.59 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.458 -1.401 . . . . 0.0 109.483 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.52 2.73 52.71 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.392 -0.818 . . . . 0.0 109.929 179.28 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.617 ' CZ ' HD13 ' A' ' 44' ' ' LEU . 3.0 ttp180 -67.39 173.11 4.24 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.897 -1.127 . . . . 0.0 109.51 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.76 164.85 37.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.165 -0.96 . . . . 0.0 109.773 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -44.43 -70.25 0.11 Allowed 'General case' 0 N--CA 1.504 2.236 0 CA-C-O 121.419 0.628 . . . . 0.0 109.626 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -121.38 175.16 16.12 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 108.632 -1.787 . . . . 0.0 108.632 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.524 HD11 ' O ' ' A' ' 15' ' ' THR . 4.8 mt -51.39 124.73 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.277 -1.131 . . . . 0.0 109.706 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.518 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -70.27 160.63 31.84 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.306 -0.871 . . . . 0.0 108.654 179.238 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.404 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.95 165.54 36.16 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.085 -1.01 . . . . 0.0 108.996 179.478 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -143.55 -178.33 5.84 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.213 -0.929 . . . . 0.0 109.523 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -52.15 123.67 11.18 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.31 -0.869 . . . . 0.0 108.722 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -48.41 113.48 0.76 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.61 -0.682 . . . . 0.0 109.43 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.427 ' O ' ' C ' ' A' ' 58' ' ' VAL . 24.2 ttpt -46.45 120.82 3.06 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.572 -0.705 . . . . 0.0 109.201 -179.622 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.427 ' C ' ' O ' ' A' ' 57' ' ' LYS . 1.1 p -39.53 122.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.6 t -44.83 103.72 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 53.4 p . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.453 0.644 . . . . 0.0 110.232 -178.371 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.537 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C1'-N19 110.518 3.397 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.957 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 P--O5' 1.609 1.584 1 O4'-C1'-N19 111.621 4.776 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.591 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.562 1 O4'-C1'-N19 111.119 4.149 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.591 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.483 1 O4'-C1'-N19 111.004 4.005 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.539 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.831 0 O4'-C1'-N19 110.875 3.844 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.435 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.707 0 O4'-C1'-N19 110.604 3.505 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.435 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.764 0 O4'-C1'-N19 110.781 3.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.427 ' N4 ' ' C5 ' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.745 0 O4'-C1'-N19 110.429 3.286 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.614 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.58 1 O4'-C1'-N19 111.248 4.31 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.614 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.458 1 O4'-C1'-N19 112.059 5.324 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.542 " O3'" ' HE1' ' A' ' 46' ' ' MET . . . . . . . . 0 C5'--C4' 1.526 1.931 0 O4'-C1'-N19 110.95 3.937 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 O4'-C1'-N19 110.633 3.542 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.583 ' H62' HD11 ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.532 2.61 0 O4'-C1'-N19 110.737 3.672 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.73 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.557 1 O4'-C1'-N19 112.942 6.427 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.488 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.534 2.876 1 O4'-C1'-N19 111.284 4.355 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.426 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.533 2.691 1 O4'-C1'-N19 111.185 4.231 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.9 mtpt . . . . . 0 N--CA 1.497 1.897 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.45 -43.63 17.03 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.484 -0.76 . . . . 0.0 109.06 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.99 111.04 0.92 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.714 -0.616 . . . . 0.0 109.429 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 115.23 -24.35 10.67 Favored Glycine 0 N--CA 1.496 2.687 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 -179.48 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.495 HG23 ' HB2' ' A' ' 26' ' ' PRO . 30.7 m -71.96 92.38 1.27 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.873 -1.369 . . . . 0.0 109.309 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.6 m -93.54 117.03 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.51 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 44.7 t -45.51 112.37 0.45 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.446 -0.784 . . . . 0.0 110.409 -178.99 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 39.4 m -62.5 -8.94 7.09 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.429 -0.795 . . . . 0.0 111.305 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -104.96 -26.69 12.07 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.797 -1.189 . . . . 0.0 111.199 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.603 ' HA ' ' HB3' ' A' ' 44' ' ' LEU . 13.1 p -139.67 17.14 2.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.693 -1.254 . . . . 0.0 111.334 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 49.55 22.13 0.71 Allowed 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.237 -0.914 . . . . 0.0 111.995 178.723 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.537 ' HB ' ' SG ' ' A' ' 10' ' ' CYS . 2.0 t -90.04 125.48 35.42 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.799 -1.188 . . . . 0.0 109.473 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.4 p -88.95 -21.66 23.46 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.377 -0.827 . . . . 0.0 109.38 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.4 p -89.52 117.21 28.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.359 -0.838 . . . . 0.0 109.001 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.63 HG21 ' CH2' ' A' ' 18' ' ' TRP . 6.3 p -144.86 147.51 32.9 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.923 -1.111 . . . . 0.0 110.475 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.73 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 77.0 p -80.05 -30.37 39.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.541 -0.724 . . . . 0.0 109.08 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.957 HD11 ' O6 ' ' B' ' 107' ' ' ' DG' . 12.9 mt -144.45 112.02 6.12 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.184 -0.947 . . . . 0.0 109.312 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.63 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.5 m95 -74.67 90.9 2.32 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.107 -0.995 . . . . 0.0 109.749 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.15 83.08 3.64 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.384 -0.822 . . . . 0.0 109.377 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.461 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.6 mmt180 -66.41 110.05 2.96 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.151 -0.968 . . . . 0.0 109.348 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 83.1 p -71.03 149.24 94.74 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.212 -0.93 . . . . 0.0 109.465 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -56.11 -22.34 39.24 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 122.432 2.088 . . . . 0.0 111.229 -179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -75.23 -3.43 33.12 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.196 -0.94 . . . . 0.0 110.169 179.203 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.9 34.41 9.0 Favored Glycine 0 N--CA 1.495 2.597 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -127.47 101.4 24.53 Favored Pre-proline 0 N--CA 1.494 1.741 0 O-C-N 121.458 -1.025 . . . . 0.0 110.43 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.51 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.3 Cg_endo -65.37 105.02 0.68 Allowed 'Trans proline' 0 C--N 1.315 -1.22 0 C-N-CA 122.593 2.195 . . . . 0.0 110.099 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.499 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.74 124.98 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.131 -0.981 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.489 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.0 p -49.19 131.2 19.7 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.459 0.647 . . . . 0.0 110.074 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.665 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 23.5 t-20 -37.18 -48.84 0.87 Allowed 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.629 -0.669 . . . . 0.0 111.548 -178.96 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -45.04 -44.08 9.86 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.425 -0.797 . . . . 0.0 110.296 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.525 ' HB3' ' HD3' ' A' ' 42' ' ' ARG . 3.4 m -64.03 -44.79 91.46 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.29 -33.24 85.46 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.583 HD11 ' H62' ' C' ' 124' ' ' ' DA' . 41.6 mt -76.33 -60.45 2.33 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.471 -1.017 . . . . 0.0 109.617 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.833 ' HA ' HD22 ' A' ' 37' ' ' LEU . 51.3 t80 -48.05 -38.88 18.39 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.303 -0.873 . . . . 0.0 109.289 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.495 ' CD2' ' O ' ' A' ' 40' ' ' VAL . 58.3 t80 -54.24 -53.9 47.37 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.439 -0.788 . . . . 0.0 109.602 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.04 -38.11 89.89 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.113 -0.992 . . . . 0.0 110.459 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.833 HD22 ' HA ' ' A' ' 34' ' ' TYR . 4.1 mp -42.77 -57.5 2.74 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.437 -0.79 . . . . 0.0 110.353 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.685 ' HB2' HG22 ' A' ' 40' ' ' VAL . 22.3 m80 -118.3 13.69 13.7 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.286 -0.884 . . . . 0.0 109.705 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.47 ' N ' ' O ' ' A' ' 35' ' ' TYR . 17.6 tt0 45.76 47.33 11.9 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 121.842 0.83 . . . . 0.0 109.788 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.685 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.1 m -130.86 -170.82 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 121.545 -0.722 . . . . 0.0 109.71 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -61.69 -173.62 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.267 -0.896 . . . . 0.0 110.177 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.525 ' HD3' ' HB3' ' A' ' 31' ' ' CYS . 29.7 mtt180 -130.0 93.55 33.5 Favored Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 121.1 -1.0 . . . . 0.0 109.976 -179.207 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.561 ' HD2' ' CE1' ' A' ' 34' ' ' TYR . 5.0 Cg_exo -58.75 126.63 21.78 Favored 'Trans proline' 0 C--N 1.318 -1.061 0 C-N-CA 122.559 2.173 . . . . 0.0 110.866 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.603 ' HB3' ' HA ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -96.88 17.32 17.03 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.45 -0.781 . . . . 0.0 110.586 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.2 p -74.16 -4.57 36.6 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.996 -1.065 . . . . 0.0 110.198 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.542 ' HE1' " O3'" ' C' ' 122' ' ' ' DT' . 1.0 OUTLIER -103.91 -0.66 28.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.082 -1.011 . . . . 0.0 110.626 179.819 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 9.4 mmm180 -51.13 141.36 14.44 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.628 -1.295 . . . . 0.0 110.215 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmm -119.38 -163.99 1.02 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.514 -0.741 . . . . 0.0 109.52 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -79.51 -89.35 0.06 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.209 -0.932 . . . . 0.0 110.175 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -96.11 165.91 24.34 Favored Glycine 0 N--CA 1.499 2.864 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.405 HD11 ' C ' ' A' ' 15' ' ' THR . 5.4 mt -54.3 129.06 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.246 -1.15 . . . . 0.0 109.767 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -70.33 141.91 52.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.297 -0.877 . . . . 0.0 109.275 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.72 158.13 40.54 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.946 -1.097 . . . . 0.0 110.159 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.471 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 1.1 mtm-85 -153.16 -158.47 0.89 Allowed 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -58.37 106.11 0.35 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.04 139.29 4.54 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.521 0.677 . . . . 0.0 110.94 -178.475 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.65 140.78 40.19 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.581 -0.699 . . . . 0.0 109.949 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -61.68 163.99 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.529 -0.732 . . . . 0.0 110.228 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.53 110.45 4.2 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.084 -1.01 . . . . 0.0 109.601 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.9 t . . . . . 0 N--CA 1.497 1.875 0 O-C-N 121.123 -0.986 . . . . 0.0 109.498 179.734 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.493 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.441 1.618 0 C5'-C4'-C3' 109.816 -3.256 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.502 H2'' " O5'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.598 1 O4'-C1'-N19 111.371 4.464 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.618 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.804 0 O4'-C1'-N19 110.805 3.756 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.618 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.782 0 O4'-C1'-N19 110.885 3.856 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.454 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.705 0 O4'-C1'-N19 110.719 3.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.798 0 O4'-C1'-N19 110.616 3.52 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.48 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.614 0 O4'-C1'-N19 110.99 3.987 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.48 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.78 0 C3'-C2'-C1' 107.055 3.111 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.646 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.777 1 O4'-C1'-N19 111.005 4.006 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.646 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.649 1 O4'-C1'-N19 111.929 5.162 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.635 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.278 0 O4'-C1'-N19 110.919 3.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.521 ' H71' ' HB3' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.524 1.674 0 C3'-C2'-C1' 107.106 3.147 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.735 ' H62' HD11 ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.187 0 O4'-C1'-N19 110.314 3.142 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.591 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.626 1 O4'-C1'-N19 112.209 5.511 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.591 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.595 0 O4'-C1'-N19 110.479 3.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.421 ' C6 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.118 0 O4'-C1'-N19 110.897 3.871 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.3 ptpp? . . . . . 0 N--CA 1.498 1.974 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -100.66 86.36 3.1 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.498 -0.751 . . . . 0.0 109.392 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.34 141.02 57.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.314 -0.866 . . . . 0.0 109.42 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.474 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 94.35 -37.13 3.49 Favored Glycine 0 N--CA 1.497 2.759 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.315 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.4 m -60.61 96.37 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.273 -1.134 . . . . 0.0 109.231 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.474 HG13 ' O ' ' A' ' 4' ' ' GLY . 20.8 m -96.94 138.72 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.532 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 22.1 t -59.88 122.67 14.82 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.425 -0.797 . . . . 0.0 110.835 -178.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -65.45 -16.04 63.24 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.193 -0.942 . . . . 0.0 109.965 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 3.2 m120 -104.11 -19.17 14.26 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.031 -1.043 . . . . 0.0 111.209 -179.443 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.517 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 9.0 p -154.0 26.28 0.48 Allowed 'General case' 0 N--CA 1.502 2.154 0 O-C-N 120.63 -1.294 . . . . 0.0 111.151 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.658 ' OE1' HD13 ' A' ' 44' ' ' LEU . 1.0 OUTLIER 31.15 37.11 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.642 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 178.901 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.591 HG23 HG22 ' A' ' 15' ' ' THR . 5.5 t -90.39 131.85 35.93 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.565 -1.335 . . . . 0.0 108.794 178.586 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 91.6 p -89.39 -26.37 21.06 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.447 -0.783 . . . . 0.0 109.426 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.5 p -99.51 113.3 25.6 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.485 -0.76 . . . . 0.0 109.124 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.591 HG22 HG23 ' A' ' 12' ' ' THR . 6.8 p -132.96 164.29 27.29 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.31 -0.869 . . . . 0.0 110.197 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.58 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 11.5 p -74.85 -45.95 39.67 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.427 ' CD1' ' O6 ' ' B' ' 107' ' ' ' DG' . 12.8 mt -147.57 116.49 6.8 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.691 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -64.96 98.92 0.31 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.475 -0.765 . . . . 0.0 110.112 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.88 75.38 6.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.514 -0.741 . . . . 0.0 109.62 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.9 tpp180 -64.2 95.59 0.13 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.277 -0.889 . . . . 0.0 108.976 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.14 147.13 47.38 Favored Pre-proline 0 N--CA 1.499 2.017 0 O-C-N 121.437 -0.789 . . . . 0.0 110.133 -179.184 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -56.16 -33.66 91.01 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.383 2.055 . . . . 0.0 110.696 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.8 mtm -60.32 -23.15 63.98 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.214 -0.929 . . . . 0.0 109.537 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.89 45.64 1.01 Allowed Glycine 0 N--CA 1.497 2.733 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -134.84 104.26 10.77 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.468 -1.019 . . . . 0.0 110.277 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.508 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 Cg_endo -66.13 87.59 0.25 Allowed 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 122.317 2.011 . . . . 0.0 109.639 178.918 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.532 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -109.53 124.48 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.111 -0.993 . . . . 0.0 110.371 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.553 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.5 p -46.25 134.28 8.82 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.744 -0.597 . . . . 0.0 109.591 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.419 ' C ' ' O ' ' A' ' 28' ' ' CYS . 2.2 t-20 -34.74 -46.29 0.29 Allowed 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.747 -0.595 . . . . 0.0 111.46 -179.006 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.653 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -47.66 -51.81 20.33 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.509 -0.745 . . . . 0.0 111.27 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.533 ' HA ' ' HD3' ' A' ' 42' ' ' ARG . 52.0 m -62.35 -40.86 97.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.148 -0.97 . . . . 0.0 109.885 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.11 -35.69 91.86 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.735 HD11 ' H62' ' C' ' 124' ' ' ' DA' . 83.6 mt -73.69 -62.19 1.58 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.294 -1.121 . . . . 0.0 109.717 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.475 ' CE1' ' HB3' ' A' ' 42' ' ' ARG . 32.1 t80 -51.71 -38.36 54.86 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.547 ' O ' ' N ' ' A' ' 39' ' ' GLN . 32.1 t80 -64.28 -43.72 93.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.465 -0.772 . . . . 0.0 110.118 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HD2' ' CD1' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -60.44 -21.92 62.84 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 119.988 -1.695 . . . . 0.0 110.059 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.54 ' CD1' ' HD2' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -84.74 -59.18 2.43 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.074 -1.016 . . . . 0.0 110.087 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -93.03 -28.48 16.36 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.21 -0.931 . . . . 0.0 109.695 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 35' ' ' TYR . 4.7 tt0 61.86 47.8 5.8 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 122.262 1.029 . . . . 0.0 109.999 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -141.17 168.56 15.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -71.4 125.75 27.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.788 -1.195 . . . . 0.0 108.429 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.533 ' HD3' ' HA ' ' A' ' 31' ' ' CYS . 1.8 ptm180 -95.5 146.99 32.3 Favored Pre-proline 0 N--CA 1.493 1.706 0 O-C-N 121.229 -0.919 . . . . 0.0 109.496 -178.873 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.572 ' HB2' HG22 ' A' ' 45' ' ' THR . 1.8 Cg_endo -62.71 133.53 42.66 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 C-N-CA 122.196 1.93 . . . . 0.0 110.565 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.658 HD13 ' OE1' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -76.51 -6.93 53.95 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.468 -0.77 . . . . 0.0 110.375 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.572 HG22 ' HB2' ' A' ' 43' ' ' PRO . 14.6 t -60.66 -28.09 68.31 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.12 -0.987 . . . . 0.0 110.798 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -77.54 -21.44 52.6 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.916 -1.115 . . . . 0.0 110.178 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.57 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -76.08 149.72 37.41 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.022 -1.049 . . . . 0.0 108.997 179.417 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.407 ' N ' ' HG2' ' A' ' 47' ' ' ARG . 34.8 mttm -124.84 -166.07 1.48 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.016 -1.052 . . . . 0.0 110.013 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -91.69 -45.56 8.38 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.072 -1.017 . . . . 0.0 109.9 -179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -95.08 135.46 12.42 Favored Glycine 0 N--CA 1.499 2.873 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.8 mt -50.62 120.97 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.164 -1.197 . . . . 0.0 109.802 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -63.39 151.14 41.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.632 -0.667 . . . . 0.0 109.895 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.451 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -156.32 154.98 31.46 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.977 -1.077 . . . . 0.0 109.366 178.853 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 53' ' ' THR . 5.9 mtp180 -150.89 -161.87 1.43 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -53.25 130.73 35.67 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.928 -1.107 . . . . 0.0 109.136 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.451 ' HD3' ' OP1' ' C' ' 126' ' ' ' DC' . 20.3 mtt180 -76.14 160.43 29.75 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.418 -0.801 . . . . 0.0 110.125 -179.053 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -79.5 124.23 28.29 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.358 -0.839 . . . . 0.0 109.722 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.1 t -61.91 144.48 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.48 -0.762 . . . . 0.0 109.467 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.2 t -64.68 100.16 0.37 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.33 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.496 1.862 0 O-C-N 121.335 -0.853 . . . . 0.0 109.684 -179.388 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.512 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.444 1.813 0 O4'-C1'-N19 110.722 3.653 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.512 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.775 1 O4'-C1'-N19 111.645 4.807 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.657 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.228 1 O4'-C1'-N19 111.234 4.292 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.657 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.13 1 O4'-C1'-N19 111.12 4.15 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.456 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.141 0 O4'-C1'-N19 110.664 3.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.416 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.018 1 O4'-C1'-N19 111.042 4.052 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.416 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.001 1 O4'-C1'-N19 111.38 4.475 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.425 " H5'" ' CZ ' ' A' ' 54' ' ' ARG . . . . . . . . 0 P--O5' 1.612 1.865 0 C3'-C2'-C1' 107.182 3.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.684 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.786 1 O4'-C1'-N19 111.231 4.288 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.684 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.381 1 O4'-C1'-N19 111.861 5.076 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.658 ' OP2' HD23 ' A' ' 37' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.095 1 O4'-C1'-N19 111.169 4.211 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.468 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.756 0 O4'-C1'-N19 110.371 3.214 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.693 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.313 0 O4'-C1'-N19 110.705 3.632 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.86 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.527 1.942 1 O4'-C1'-N19 112.169 5.462 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.631 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.791 1 O4'-C1'-N19 111.129 4.161 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.429 ' H71' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.956 1 O4'-C1'-N19 111.109 4.137 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.771 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.3 mpp_? -87.21 7.38 28.64 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.208 -0.933 . . . . 0.0 110.353 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.33 142.97 58.19 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.068 -1.02 . . . . 0.0 109.284 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.51 -30.66 9.2 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 109.211 -1.555 . . . . 0.0 109.211 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.612 HG23 ' HB2' ' A' ' 26' ' ' PRO . 15.5 m -70.77 89.09 0.74 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -1.17 . . . . 0.0 109.627 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 6' ' ' VAL . 20.3 m -97.06 124.11 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 7.9 t -43.66 113.99 0.58 Allowed 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.395 -0.816 . . . . 0.0 111.269 -178.523 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.3 m -59.62 -10.65 3.75 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.106 -0.996 . . . . 0.0 111.178 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -110.4 -28.66 8.46 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.812 -1.18 . . . . 0.0 110.956 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.568 ' O ' ' HD3' ' A' ' 47' ' ' ARG . 2.4 p -138.32 21.97 2.77 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 120.877 -1.139 . . . . 0.0 110.159 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER 30.53 37.57 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 179.272 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.453 ' O ' HG23 ' A' ' 12' ' ' THR . 14.9 t -90.83 126.22 35.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.783 -1.198 . . . . 0.0 109.072 178.777 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 p -89.66 -15.01 33.6 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.51 -0.744 . . . . 0.0 109.699 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -102.7 99.77 9.76 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.287 -0.883 . . . . 0.0 109.386 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.463 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 6.5 p -122.6 163.05 20.71 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.175 -0.953 . . . . 0.0 110.292 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.86 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 81.9 p -94.11 -32.17 13.87 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.658 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 67.5 mt -142.75 87.23 1.98 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.317 -0.864 . . . . 0.0 109.263 179.119 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.463 ' CZ2' HG23 ' A' ' 15' ' ' THR . 13.1 m95 -54.54 109.27 0.48 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.077 -1.014 . . . . 0.0 110.162 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -101.66 130.23 47.98 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.348 -0.845 . . . . 0.0 109.018 179.658 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.9 mmt180 -97.27 109.62 22.34 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.248 -0.908 . . . . 0.0 108.875 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.74 146.5 98.49 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.177 -0.952 . . . . 0.0 109.392 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -58.1 -21.09 49.17 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 C-N-CA 122.2 1.934 . . . . 0.0 110.613 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 10.8 mtt -81.54 -0.96 44.43 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.317 -0.864 . . . . 0.0 109.788 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.89 35.43 7.73 Favored Glycine 0 N--CA 1.497 2.711 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -124.22 105.24 31.47 Favored Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.386 -1.067 . . . . 0.0 110.524 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.612 ' HB2' HG23 ' A' ' 5' ' ' THR . 1.5 Cg_endo -66.63 93.27 0.31 Allowed 'Trans proline' 0 C--N 1.314 -1.27 0 C-N-CA 122.235 1.957 . . . . 0.0 109.579 178.611 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.534 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -109.75 124.47 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 121.107 -0.996 . . . . 0.0 110.561 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.426 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.4 p -45.97 131.43 9.72 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.753 -0.592 . . . . 0.0 110.398 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.658 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 7.2 t-20 -36.63 -45.56 0.53 Allowed 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.708 -0.62 . . . . 0.0 111.934 -178.869 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.24 -49.05 34.77 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.563 -0.711 . . . . 0.0 109.93 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.618 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 8.9 m -59.65 -46.35 89.27 Favored 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -55.03 -54.6 32.83 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.525 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 96.0 mt -59.23 -57.62 12.24 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.644 -0.915 . . . . 0.0 109.594 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.417 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 30.6 t80 -43.8 -36.4 2.29 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.339 -0.851 . . . . 0.0 109.59 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.49 ' O ' ' N ' ' A' ' 39' ' ' GLN . 38.7 t80 -58.82 -52.81 64.12 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.333 -0.854 . . . . 0.0 109.722 178.904 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -65.65 -26.97 68.05 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.964 -1.085 . . . . 0.0 110.483 -179.945 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.658 HD23 ' OP2' ' C' ' 122' ' ' ' DT' . 9.8 mp -53.53 -57.69 9.82 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.215 -0.928 . . . . 0.0 109.285 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.501 ' CB ' HG22 ' A' ' 40' ' ' VAL . 76.8 m-70 -113.79 11.65 18.07 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.18 -0.95 . . . . 0.0 109.771 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.49 ' N ' ' O ' ' A' ' 35' ' ' TYR . 4.9 tm0? 51.92 30.93 7.77 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.362 -0.836 . . . . 0.0 110.018 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.501 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.2 m -131.38 -171.29 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.35 -0.844 . . . . 0.0 109.516 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -66.72 -173.2 0.21 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.249 -0.907 . . . . 0.0 110.105 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.618 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -142.78 116.62 6.3 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.102 -0.999 . . . . 0.0 109.702 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -63.37 147.79 93.25 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 C-N-CA 122.069 1.846 . . . . 0.0 110.302 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.37 16.71 9.61 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.199 -0.938 . . . . 0.0 110.392 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.06 -12.95 60.21 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.054 -1.029 . . . . 0.0 109.858 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.424 ' O ' ' HG3' ' A' ' 46' ' ' MET . 0.0 OUTLIER -89.36 -5.23 57.65 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.034 -1.041 . . . . 0.0 110.664 179.632 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.568 ' HD3' ' O ' ' A' ' 10' ' ' CYS . 65.6 mtm180 -57.27 165.25 1.48 Allowed 'General case' 0 N--CA 1.504 2.236 0 O-C-N 120.65 -1.281 . . . . 0.0 110.571 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.22 145.62 31.39 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.421 -0.799 . . . . 0.0 109.926 179.036 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -47.6 -36.57 10.96 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.636 -0.665 . . . . 0.0 110.01 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.0 146.84 18.76 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 108.48 -1.848 . . . . 0.0 108.48 179.042 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.555 HG21 HG22 ' A' ' 16' ' ' THR . 5.3 mt -46.73 114.79 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 121.474 -1.015 . . . . 0.0 110.016 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -51.55 142.32 14.37 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.579 -0.701 . . . . 0.0 109.497 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.36 159.09 39.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.96 -1.087 . . . . 0.0 110.054 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.425 ' CZ ' " H5'" ' B' ' 113' ' ' ' DC' . 0.1 OUTLIER -150.57 -157.65 0.83 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.703 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -62.74 97.18 0.1 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 120.884 -1.135 . . . . 0.0 108.726 179.048 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.439 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 0.2 OUTLIER -45.06 143.59 1.51 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.678 -0.639 . . . . 0.0 110.473 -179.114 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.451 ' HE2' " O4'" ' B' ' 110' ' ' ' DA' . 0.0 OUTLIER -54.92 119.53 5.54 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.397 -0.814 . . . . 0.0 110.086 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.4 p -67.91 139.4 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.536 -0.728 . . . . 0.0 109.545 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.6 m -66.76 109.49 2.9 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.314 -0.866 . . . . 0.0 110.49 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.2 t . . . . . 0 N--CA 1.495 1.798 0 O-C-N 121.388 -0.82 . . . . 0.0 109.594 179.554 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.574 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.919 0 O4'-C1'-N19 110.61 3.512 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.574 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.081 1 O4'-C1'-N19 111.685 4.856 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.551 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.511 1 O4'-C1'-N19 111.307 4.383 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.551 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.552 1 O4'-C1'-N19 111.288 4.36 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.494 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.612 1.896 0 O4'-C1'-N19 110.6 3.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.442 1.718 0 O4'-C1'-N19 110.791 3.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.643 1 O4'-C1'-N19 111.537 4.671 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.861 0 O4'-C1'-N19 110.531 3.414 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.675 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.832 0 O4'-C1'-N19 110.977 3.971 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.675 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.594 1 O4'-C1'-N19 111.83 5.037 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.551 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.089 0 O4'-C1'-N19 110.999 3.999 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.477 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.722 0 O4'-C1'-N19 110.531 3.414 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.488 ' N6 ' ' N6 ' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.568 0 O4'-C1'-N19 110.656 3.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.629 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.321 1 O4'-C1'-N19 112.465 5.831 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.556 " H2'" ' C5 ' ' C' ' 127' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.726 0 O4'-C1'-N19 110.757 3.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.556 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 P--O5' 1.616 2.33 1 O4'-C1'-N19 111.029 4.036 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.5 tptt . . . . . 0 N--CA 1.498 1.961 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.27 -41.68 76.22 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.121 -0.987 . . . . 0.0 109.352 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.99 152.61 19.38 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.771 -0.581 . . . . 0.0 109.589 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.32 -19.67 50.99 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.598 HG23 ' HB2' ' A' ' 26' ' ' PRO . 54.5 m -69.19 87.84 0.42 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.049 -1.266 . . . . 0.0 109.249 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 6' ' ' VAL . 34.6 m -78.8 110.12 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.5 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 41.0 t -47.44 109.44 0.22 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.262 -0.899 . . . . 0.0 110.391 -178.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 24.7 m -59.39 -12.49 6.03 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.326 -0.859 . . . . 0.0 111.628 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.7 ' OD1' HG11 ' A' ' 27' ' ' VAL . 2.1 m120 -95.61 -28.84 14.64 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.612 -1.305 . . . . 0.0 111.059 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.644 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 15.0 p -142.37 17.22 2.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.863 -1.148 . . . . 0.0 111.494 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 4.3 mp0 53.43 18.65 1.4 Allowed 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.2 -0.937 . . . . 0.0 112.052 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.575 HG22 ' SG ' ' A' ' 10' ' ' CYS . 14.5 t -84.15 128.72 34.74 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.401 -1.437 . . . . 0.0 109.786 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.2 p -89.72 -28.46 19.39 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.444 -0.785 . . . . 0.0 109.533 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.436 ' HB ' HG13 ' A' ' 51' ' ' ILE . 27.9 p -93.32 127.44 38.92 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.647 ' O ' HD11 ' A' ' 51' ' ' ILE . 4.8 p -146.44 145.49 30.25 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.034 -1.041 . . . . 0.0 110.097 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.629 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 25.1 p -68.0 -32.06 72.18 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.104 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 13.5 mt -149.03 122.6 9.15 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.332 -0.855 . . . . 0.0 109.57 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.565 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.8 m95 -80.89 109.13 15.17 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.302 -0.874 . . . . 0.0 110.255 -179.535 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.09 78.69 4.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.39 -0.819 . . . . 0.0 108.904 179.452 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.8 122.9 15.99 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.216 -0.927 . . . . 0.0 109.872 -179.554 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.7 143.26 37.95 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.592 -0.693 . . . . 0.0 109.518 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -56.86 -38.82 94.98 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.496 2.13 . . . . 0.0 110.742 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.36 -23.73 50.83 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.405 -0.809 . . . . 0.0 109.586 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.78 39.06 1.63 Allowed Glycine 0 N--CA 1.496 2.658 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -133.18 97.15 16.73 Favored Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.397 -1.061 . . . . 0.0 110.177 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.598 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.9 Cg_endo -63.98 112.68 1.91 Allowed 'Trans proline' 0 C--N 1.312 -1.387 0 C-N-CA 122.091 1.861 . . . . 0.0 109.952 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.7 HG11 ' OD1' ' A' ' 9' ' ' ASN . 3.3 m -122.62 129.1 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.074 -1.017 . . . . 0.0 110.5 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.522 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.2 p -52.68 139.2 26.84 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 121.441 0.638 . . . . 0.0 110.559 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 19.7 t-20 -40.35 -47.78 2.58 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.88 -0.512 . . . . 0.0 112.071 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.43 -41.68 52.91 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.195 -0.941 . . . . 0.0 110.355 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.409 ' HB3' ' HD2' ' A' ' 42' ' ' ARG . 9.6 m -66.77 -36.81 83.29 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.156 -0.965 . . . . 0.0 108.526 178.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.81 -48.79 59.24 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.436 ' O ' HD13 ' A' ' 37' ' ' LEU . 93.8 mt -61.04 -59.44 5.36 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.583 -0.951 . . . . 0.0 109.619 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.487 ' CD1' ' HB3' ' A' ' 42' ' ' ARG . 18.4 t80 -47.97 -40.35 22.07 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.564 -0.71 . . . . 0.0 109.515 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.446 ' HB2' ' NH1' ' A' ' 42' ' ' ARG . 41.4 t80 -58.33 -49.9 75.53 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.313 -0.867 . . . . 0.0 109.62 179.209 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 tttt -61.14 -34.66 75.36 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.979 -1.076 . . . . 0.0 109.945 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.436 HD13 ' O ' ' A' ' 33' ' ' LEU . 9.1 mp -53.62 -63.27 1.2 Allowed 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.657 -0.652 . . . . 0.0 110.682 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.534 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 83.1 m-70 -105.93 12.58 30.44 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.121 -0.987 . . . . 0.0 110.39 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER 47.42 28.35 1.1 Allowed 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 121.614 0.721 . . . . 0.0 110.895 -179.327 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.497 HG22 ' CB ' ' A' ' 38' ' ' HIS . 8.2 m -130.96 -170.45 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 O-C-N 121.203 -0.936 . . . . 0.0 109.873 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -62.47 -177.27 0.13 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.497 -0.752 . . . . 0.0 109.853 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.487 ' HB3' ' CD1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -146.28 111.17 4.33 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 120.902 -1.124 . . . . 0.0 110.179 -179.524 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -60.15 134.04 53.56 Favored 'Trans proline' 0 C--N 1.316 -1.157 0 C-N-CA 122.115 1.877 . . . . 0.0 110.298 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.644 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 1.2 pp -88.8 9.93 22.83 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.303 -0.873 . . . . 0.0 110.835 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 43.7 p -70.36 -9.93 57.6 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.064 -1.022 . . . . 0.0 110.569 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 ttt -95.77 -22.05 17.75 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.94 -1.1 . . . . 0.0 110.531 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.467 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -67.27 152.02 46.47 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.829 -1.169 . . . . 0.0 110.055 -179.895 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.413 ' HB2' ' OE1' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -106.94 -160.52 0.74 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.379 -0.826 . . . . 0.0 109.716 179.836 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -47.67 -73.2 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.264 -0.897 . . . . 0.0 110.698 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -136.48 -158.52 8.09 Favored Glycine 0 N--CA 1.498 2.778 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.647 HD11 ' O ' ' A' ' 15' ' ' THR . 9.3 mt -50.91 111.15 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.223 -1.163 . . . . 0.0 110.033 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.413 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -78.16 156.45 29.87 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.423 -0.798 . . . . 0.0 109.213 179.612 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -154.99 163.05 40.85 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.137 -0.977 . . . . 0.0 109.718 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.85 -168.77 3.2 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.04 124.88 23.75 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.944 -1.097 . . . . 0.0 108.99 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.405 ' HD3' ' OP1' ' C' ' 126' ' ' ' DC' . 29.5 mtt180 -53.22 136.84 35.72 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.438 -0.789 . . . . 0.0 110.07 -179.084 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.43 151.02 41.28 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.538 -0.727 . . . . 0.0 109.799 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.3 p -52.69 138.91 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.336 -0.853 . . . . 0.0 109.88 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.65 111.06 1.68 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.3 -0.875 . . . . 0.0 109.475 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.6 t . . . . . 0 N--CA 1.498 1.947 0 O-C-N 121.649 -0.657 . . . . 0.0 110.205 -179.491 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.504 ' C6 ' ' C6 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.524 1.663 0 O4'-C1'-N19 110.526 3.407 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.845 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.442 1.664 0 O4'-C1'-N19 110.784 3.73 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.579 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.914 0 O4'-C1'-N19 110.904 3.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.579 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.694 0 O4'-C1'-N19 110.659 3.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.43 H2'' ' C8 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.821 0 O4'-C1'-N19 110.859 3.824 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.444 " H4'" ' HG2' ' A' ' 57' ' ' LYS . . . . . . . . 0 O4'--C1' 1.443 1.805 0 O4'-C1'-N19 110.675 3.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.484 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.442 1.694 1 O4'-C1'-N19 111.297 4.372 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.484 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.819 0 C3'-C2'-C1' 107.194 3.21 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.652 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.796 0 O4'-C1'-N19 110.712 3.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.652 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.669 1 O4'-C1'-N19 111.672 4.84 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.621 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.213 1 O4'-C1'-N19 111.026 4.033 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.487 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 P--O5' 1.61 1.707 0 C3'-C2'-C1' 107.088 3.134 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.66 ' H62' ' CD1' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.531 2.486 0 O4'-C1'-N19 110.541 3.427 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.666 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.808 1 O4'-C1'-N19 112.641 6.051 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.469 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.534 2.838 0 O4'-C1'-N19 110.84 3.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.463 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.2 0 O4'-C1'-N19 110.874 3.843 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.498 1.959 0 CA-C-O 120.437 0.16 . . . . 0.0 111.333 . . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.3 -27.03 60.53 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.73 -1.231 . . . . 0.0 109.839 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.9 140.73 41.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.28 -0.887 . . . . 0.0 109.407 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.31 -22.57 32.5 Favored Glycine 0 N--CA 1.498 2.806 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 -179.315 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.402 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 26.4 m -66.9 99.87 0.67 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.121 -1.223 . . . . 0.0 109.717 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.8 m -97.82 104.32 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.577 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 42.3 t -40.72 106.88 0.06 Allowed 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.719 -0.613 . . . . 0.0 110.549 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.4 m -57.31 -17.22 11.16 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.554 -0.716 . . . . 0.0 111.595 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.499 ' OD1' HG11 ' A' ' 27' ' ' VAL . 5.3 m120 -95.43 -30.91 13.63 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.654 -1.278 . . . . 0.0 111.419 -179.018 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.493 ' SG ' ' HB ' ' A' ' 12' ' ' THR . 13.3 p -133.15 17.94 4.08 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.557 -1.34 . . . . 0.0 111.06 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 7' ' ' CYS . 26.4 mt-30 44.67 31.78 0.69 Allowed 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.318 -0.863 . . . . 0.0 112.108 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.498 HG22 ' CB ' ' A' ' 7' ' ' CYS . 3.2 t -90.61 127.38 36.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.655 -1.278 . . . . 0.0 109.376 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.21 -20.48 24.13 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.578 -0.701 . . . . 0.0 109.29 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.455 HG21 ' O ' ' A' ' 49' ' ' ASP . 18.7 p -106.79 133.86 50.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.209 -0.932 . . . . 0.0 109.021 179.184 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.552 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 8.0 p -146.06 156.59 43.57 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.219 -0.926 . . . . 0.0 110.502 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.666 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 43.4 p -87.02 -29.59 21.85 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.845 HD11 ' O6 ' ' B' ' 107' ' ' ' DG' . 24.5 mt -146.33 91.01 2.0 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.282 -0.886 . . . . 0.0 109.289 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.552 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.8 m95 -54.7 102.67 0.07 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.947 -1.095 . . . . 0.0 109.545 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -101.13 95.22 6.41 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.454 -0.779 . . . . 0.0 110.128 -178.935 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.3 mmt180 -62.74 110.29 1.69 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.194 -0.942 . . . . 0.0 108.895 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.6 137.78 83.25 Favored Pre-proline 0 N--CA 1.496 1.862 0 O-C-N 121.195 -0.941 . . . . 0.0 110.182 -179.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -56.39 -29.59 77.92 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 C-N-CA 122.701 2.267 . . . . 0.0 110.832 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 18.9 ttm -54.88 -25.25 27.68 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.577 -0.702 . . . . 0.0 109.483 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.43 30.92 2.94 Favored Glycine 0 N--CA 1.497 2.726 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -140.27 124.34 10.7 Favored Pre-proline 0 N--CA 1.493 1.678 0 O-C-N 121.165 -1.197 . . . . 0.0 110.107 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.542 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.7 Cg_endo -65.94 104.16 0.67 Allowed 'Trans proline' 0 C--N 1.314 -1.275 0 C-N-CA 122.143 1.895 . . . . 0.0 109.805 179.293 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.577 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -117.3 127.27 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-O 122.156 0.979 . . . . 0.0 110.731 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.532 ' SG ' ' HB3' ' A' ' 30' ' ' ALA . 12.0 p -48.97 138.32 11.72 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.726 -0.609 . . . . 0.0 109.594 179.11 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.671 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 1.6 t-20 -44.68 -33.3 1.79 Allowed 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.519 -0.738 . . . . 0.0 110.779 -179.298 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.532 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -54.63 -48.44 72.26 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.088 -1.008 . . . . 0.0 109.584 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.461 ' SG ' ' HD3' ' A' ' 42' ' ' ARG . 26.8 m -64.18 -39.11 93.31 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.434 -0.791 . . . . 0.0 109.382 179.177 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.54 -28.65 72.09 Favored Glycine 0 N--CA 1.496 2.633 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.66 ' CD1' ' H62' ' C' ' 124' ' ' ' DA' . 42.5 mt -76.91 -70.1 0.48 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.319 -1.107 . . . . 0.0 110.387 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.524 ' HA ' HD13 ' A' ' 37' ' ' LEU . 7.7 t80 -43.83 -35.59 1.99 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.352 -0.843 . . . . 0.0 109.146 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.528 ' O ' ' HA ' ' A' ' 39' ' ' GLN . 28.6 t80 -58.55 -51.92 67.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.481 -0.762 . . . . 0.0 110.527 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.546 ' HD3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -59.59 -22.43 61.76 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.392 -1.442 . . . . 0.0 110.723 -179.534 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.524 HD13 ' HA ' ' A' ' 34' ' ' TYR . 1.9 mp -73.73 -69.32 0.44 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.41 -0.806 . . . . 0.0 110.249 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.549 ' HB2' HG22 ' A' ' 40' ' ' VAL . 35.5 m-70 -100.96 15.08 29.8 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.282 -0.886 . . . . 0.0 110.191 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.528 ' HA ' ' O ' ' A' ' 35' ' ' TYR . 4.4 pm0 36.86 43.88 0.32 Allowed 'General case' 0 N--CA 1.503 2.203 0 CA-C-O 121.547 0.689 . . . . 0.0 111.45 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.549 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.2 m -132.92 178.4 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 O-C-N 121.434 -0.792 . . . . 0.0 109.989 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -70.4 172.95 7.49 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.286 -0.883 . . . . 0.0 110.475 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' HD3' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -131.83 131.73 22.85 Favored Pre-proline 0 N--CA 1.501 2.123 0 O-C-N 121.306 -0.871 . . . . 0.0 109.226 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.574 ' HB2' HG22 ' A' ' 45' ' ' THR . 3.3 Cg_endo -68.44 146.56 68.77 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 122.492 2.128 . . . . 0.0 111.674 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.505 ' O ' ' HB3' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -92.93 -3.24 54.88 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.617 -0.677 . . . . 0.0 110.061 178.754 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.574 HG22 ' HB2' ' A' ' 43' ' ' PRO . 2.2 t -63.69 -35.78 81.67 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.914 -1.116 . . . . 0.0 110.281 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 5.4 ttt -84.38 8.56 15.79 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.99 -1.069 . . . . 0.0 110.076 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.505 ' HB3' ' O ' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -75.08 157.38 34.85 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.859 -1.15 . . . . 0.0 109.907 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -139.33 146.83 40.77 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.247 -0.908 . . . . 0.0 109.232 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ASP . . . . . 0.455 ' O ' HG21 ' A' ' 14' ' ' THR . 0.5 OUTLIER -64.89 -39.15 93.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.859 . . . . 0.0 109.625 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -98.11 130.66 10.31 Favored Glycine 0 N--CA 1.495 2.632 0 N-CA-C 109.026 -1.629 . . . . 0.0 109.026 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.59 HG21 HG22 ' A' ' 16' ' ' THR . 5.3 mt -45.93 113.13 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.664 -0.904 . . . . 0.0 109.921 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -55.17 149.77 11.91 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.689 -0.632 . . . . 0.0 110.309 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.88 160.94 40.59 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.129 -0.982 . . . . 0.0 109.462 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -151.5 -161.64 1.37 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.655 -0.653 . . . . 0.0 109.858 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -55.99 133.66 51.85 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.074 -1.016 . . . . 0.0 108.949 179.27 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -61.32 158.99 13.17 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 121.607 0.718 . . . . 0.0 110.199 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' LYS . . . . . 0.444 ' HG2' " H4'" ' B' ' 111' ' ' ' DA' . 6.4 ttmt -82.68 135.43 35.02 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 0.0 110.0 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.6 t -74.54 150.42 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.199 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.4 p -64.56 114.2 4.21 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.067 -1.02 . . . . 0.0 109.007 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.497 1.897 0 O-C-N 121.305 -0.872 . . . . 0.0 109.757 -179.084 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.567 ' H62' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.443 1.801 0 O4'-C1'-N19 110.647 3.558 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.528 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.871 1 O4'-C1'-N19 111.912 5.14 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.599 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.469 1 O4'-C1'-N19 111.488 4.611 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.599 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.277 1 O4'-C1'-N19 111.284 4.355 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.523 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.889 0 O4'-C1'-N19 110.912 3.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.425 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.857 0 O4'-C1'-N19 110.925 3.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.425 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.931 1 O4'-C1'-N19 111.325 4.407 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.422 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.611 1.81 0 O4'-C1'-N19 110.391 3.239 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.678 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.752 1 O4'-C1'-N19 111.562 4.703 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.678 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.654 1 O4'-C1'-N19 112.087 5.358 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.557 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.657 1 O4'-C1'-N19 111.307 4.384 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.49 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.098 0 O4'-C1'-N19 110.635 3.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.595 ' H62' ' CD1' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.357 0 O4'-C1'-N19 110.584 3.48 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.525 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.532 2.586 1 O4'-C1'-N19 112.515 5.894 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.498 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.063 0 O4'-C1'-N19 110.796 3.744 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.453 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.07 0 O4'-C1'-N19 110.899 3.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 1' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 3' ' ' ALA . 5.6 mttt . . . . . 0 N--CA 1.5 2.047 0 N-CA-C 110.427 -0.212 . . . . 0.0 110.427 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.95 90.81 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.48 -0.763 . . . . 0.0 110.665 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.422 ' N ' ' O ' ' A' ' 1' ' ' LYS . . . -64.21 90.98 0.07 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.54 -0.725 . . . . 0.0 109.834 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 53.42 36.64 53.94 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.449 ' O ' ' CH2' ' A' ' 18' ' ' TRP . 25.2 m -55.45 94.54 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.553 -0.969 . . . . 0.0 109.857 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.4 m -89.95 112.31 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.587 ' HB3' HG22 ' A' ' 12' ' ' THR . 38.7 t -44.18 109.44 0.15 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.498 -0.751 . . . . 0.0 110.669 -178.185 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.7 m -57.73 -20.08 32.12 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.11 -0.994 . . . . 0.0 111.72 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.455 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 9.4 m-20 -85.67 -30.74 22.96 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.951 -1.093 . . . . 0.0 110.786 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.578 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 18.6 p -141.86 24.84 2.0 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.666 -1.271 . . . . 0.0 111.103 179.562 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.512 ' N ' ' O ' ' A' ' 7' ' ' CYS . 2.8 pt20 40.36 26.95 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.786 -0.571 . . . . 0.0 111.936 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.587 HG22 ' HB3' ' A' ' 7' ' ' CYS . 5.7 t -85.65 130.13 34.65 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.779 -1.201 . . . . 0.0 109.531 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -90.66 6.12 45.21 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.533 -0.73 . . . . 0.0 109.292 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.48 ' HB ' ' CG1' ' A' ' 51' ' ' ILE . 14.5 p -125.82 124.55 41.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.259 -0.901 . . . . 0.0 109.57 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.634 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 9.6 p -145.3 146.44 31.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.036 -1.04 . . . . 0.0 110.387 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.525 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 22.5 p -67.04 -38.54 86.07 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.007 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.567 HD11 ' H62' ' B' ' 106' ' ' ' DA' . 11.6 mt -149.86 107.61 3.68 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.634 ' CZ3' HG21 ' A' ' 15' ' ' THR . 40.9 m95 -59.27 94.83 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.515 -0.74 . . . . 0.0 110.262 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.04 87.67 5.42 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.371 -0.83 . . . . 0.0 108.951 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.11 102.8 0.32 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.402 -0.811 . . . . 0.0 109.43 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.1 t -67.59 136.98 93.02 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.351 -0.843 . . . . 0.0 110.169 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -58.98 -30.12 92.45 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 C-N-CA 122.625 2.217 . . . . 0.0 110.924 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -57.67 -24.91 59.15 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.223 -0.923 . . . . 0.0 109.281 179.397 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 113.2 33.9 1.89 Allowed Glycine 0 N--CA 1.496 2.666 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -136.77 109.27 9.25 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.21 -1.171 . . . . 0.0 110.596 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.535 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 5.8 Cg_exo -62.36 102.6 0.28 Allowed 'Trans proline' 0 C--N 1.315 -1.21 0 C-N-CA 122.155 1.903 . . . . 0.0 109.464 178.645 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.458 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -111.69 155.89 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 120.977 -1.077 . . . . 0.0 110.943 -179.345 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.507 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 15.3 p -82.32 139.58 34.06 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -38.04 -44.23 0.79 Allowed 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.762 -0.586 . . . . 0.0 111.413 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.28 -48.62 76.24 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.24 -0.912 . . . . 0.0 111.239 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 3.6 m -56.29 -49.78 73.29 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.265 -0.897 . . . . 0.0 108.663 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.09 -38.46 93.07 Favored Glycine 0 N--CA 1.494 2.554 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.595 ' CD1' ' H62' ' C' ' 124' ' ' ' DA' . 44.8 mt -67.72 -67.75 0.44 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.492 -1.005 . . . . 0.0 110.13 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.403 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 89.4 t80 -52.74 -37.36 59.18 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.445 -0.785 . . . . 0.0 109.256 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' A' ' 39' ' ' GLN . 43.3 t80 -60.74 -45.65 93.46 Favored 'General case' 0 C--O 1.2 -1.523 0 O-C-N 121.414 -0.804 . . . . 0.0 108.917 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.39 -29.74 61.86 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.194 -1.566 . . . . 0.0 110.06 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 5.4 mp -64.74 -65.82 0.62 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.945 -1.097 . . . . 0.0 110.122 -179.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -94.61 -32.73 13.28 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.228 -0.92 . . . . 0.0 109.977 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.575 ' N ' ' O ' ' A' ' 35' ' ' TYR . 21.7 tt0 72.87 46.09 0.27 Allowed 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 121.734 0.778 . . . . 0.0 110.577 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 m -140.34 167.69 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 121.395 -0.815 . . . . 0.0 109.219 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -85.16 129.88 34.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.065 -1.022 . . . . 0.0 109.036 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -130.17 146.38 61.31 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.188 -0.945 . . . . 0.0 109.882 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.0 144.31 99.48 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 C-N-CA 122.622 2.215 . . . . 0.0 111.314 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.722 HD12 ' HB2' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -78.89 48.01 0.8 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.121 -0.987 . . . . 0.0 110.739 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.5 t -66.31 -12.19 55.15 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.133 -0.98 . . . . 0.0 110.141 178.914 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -103.32 -2.28 27.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.988 -1.07 . . . . 0.0 110.565 179.489 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.722 ' HB2' HD12 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -67.1 157.93 32.4 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.631 -1.293 . . . . 0.0 110.256 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.0 mttt -143.51 -163.84 1.74 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.586 -0.696 . . . . 0.0 109.487 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.53 -74.01 0.3 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.211 -0.931 . . . . 0.0 110.015 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.45 161.74 26.44 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.48 ' CG1' ' HB ' ' A' ' 14' ' ' THR . 7.6 mt -55.32 135.43 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.238 -1.154 . . . . 0.0 110.096 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -69.87 150.02 47.24 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.363 -0.836 . . . . 0.0 109.248 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.63 160.85 40.76 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.112 -0.993 . . . . 0.0 109.763 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.411 ' CZ ' H5'' ' B' ' 113' ' ' ' DC' . 0.5 OUTLIER -151.21 175.96 11.67 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.799 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -63.49 93.05 0.07 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.421 ' HD2' ' OP1' ' C' ' 126' ' ' ' DC' . 1.8 ptt180 -47.55 130.22 13.86 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.662 -0.649 . . . . 0.0 110.503 -178.551 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.28 138.4 7.28 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.688 -0.633 . . . . 0.0 110.069 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.2 155.29 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.475 -0.765 . . . . 0.0 110.12 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -46.9 118.72 2.18 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.77 -0.582 . . . . 0.0 110.736 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.1 t . . . . . 0 N--CA 1.497 1.924 0 O-C-N 121.374 -0.829 . . . . 0.0 110.156 179.833 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.537 ' C6 ' ' C6 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.444 1.818 0 O4'-C1'-N19 110.669 3.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.724 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.525 1.764 1 O4'-C1'-N19 111.565 4.706 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.594 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.104 1 O4'-C1'-N19 111.023 4.028 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.594 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.752 0 O4'-C1'-N19 110.465 3.332 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.49 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.445 1.906 0 O4'-C1'-N19 110.738 3.672 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.424 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.12 0 O4'-C1'-N19 110.94 3.925 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.883 1 O4'-C1'-N19 111.333 4.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.929 0 C3'-C2'-C1' 107.149 3.178 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.678 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.787 1 O4'-C1'-N19 111.361 4.452 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.678 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.476 1 O4'-C1'-N19 111.885 5.106 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.507 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.965 1 O4'-C1'-N19 111.262 4.327 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.542 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.442 1.708 0 O4'-C1'-N19 110.444 3.305 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.582 " H2'" ' H71' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.639 0 O4'-C1'-N19 110.791 3.739 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.596 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.933 1 O4'-C1'-N19 111.566 4.708 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.596 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.476 0 O4'-C1'-N19 110.722 3.652 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.484 ' C6 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.552 1 O4'-C1'-N19 111.197 4.247 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 4.1 tttp . . . . . 0 N--CA 1.496 1.861 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -99.27 46.11 0.98 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.945 -1.097 . . . . 0.0 109.651 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.02 114.49 1.96 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.29 -0.881 . . . . 0.0 109.403 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.46 -35.58 2.89 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.558 HG23 ' HB2' ' A' ' 26' ' ' PRO . 3.5 m -64.68 93.77 0.11 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.282 -1.128 . . . . 0.0 109.094 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.8 m -98.65 137.64 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.641 ' HB2' HG22 ' A' ' 12' ' ' THR . 9.4 t -56.16 117.61 3.92 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.47 -0.769 . . . . 0.0 110.659 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -58.52 -16.28 14.78 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.466 -0.771 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.496 ' OD1' ' HD3' ' A' ' 42' ' ' ARG . 4.5 m-80 -109.42 -24.96 10.77 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.923 -1.111 . . . . 0.0 111.569 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.465 ' HA ' ' HB3' ' A' ' 44' ' ' LEU . 4.8 p -140.23 19.82 2.42 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.491 -1.38 . . . . 0.0 111.466 179.491 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 39.24 34.81 0.13 Allowed 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.554 -0.716 . . . . 0.0 112.841 178.066 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.641 HG22 ' HB2' ' A' ' 7' ' ' CYS . 11.0 t -89.18 132.49 34.82 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.61 -1.306 . . . . 0.0 108.822 178.524 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.74 -25.11 18.34 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.471 -0.768 . . . . 0.0 110.191 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.527 ' HB ' HG13 ' A' ' 51' ' ' ILE . 68.9 p -103.88 114.8 29.32 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.167 -0.958 . . . . 0.0 109.209 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.2 p -130.4 161.55 31.1 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 119.664 -0.814 . . . . 0.0 110.594 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.495 HG21 " H2'" ' C' ' 124' ' ' ' DA' . 6.4 p -82.8 -36.46 25.56 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.724 HD11 ' O6 ' ' B' ' 107' ' ' ' DG' . 17.8 mt -143.05 106.09 4.54 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.55 ' CH2' HG22 ' A' ' 5' ' ' THR . 16.3 m95 -64.27 107.21 1.26 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.373 -0.829 . . . . 0.0 110.391 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.602 ' HB3' HG23 ' A' ' 27' ' ' VAL . 6.8 tpt180 -81.66 72.97 8.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 108.719 179.196 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 10.7 tpp180 -63.52 92.42 0.06 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.0 143.79 91.51 Favored Pre-proline 0 N--CA 1.499 1.979 0 O-C-N 121.338 -0.851 . . . . 0.0 110.354 -178.629 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -54.5 -42.56 66.94 Favored 'Trans proline' 0 C--N 1.32 -0.967 0 C-N-CA 122.632 2.221 . . . . 0.0 111.09 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -21.16 58.58 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.283 -0.886 . . . . 0.0 109.972 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.34 42.13 1.19 Allowed Glycine 0 N--CA 1.497 2.719 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -128.7 92.82 39.28 Favored Pre-proline 0 N--CA 1.493 1.687 0 O-C-N 121.373 -1.075 . . . . 0.0 110.091 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.3 Cg_endo -64.35 95.2 0.21 Allowed 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 122.51 2.14 . . . . 0.0 110.003 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.602 HG23 ' HB3' ' A' ' 19' ' ' ARG . 2.4 m -114.05 123.26 69.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.071 -1.018 . . . . 0.0 110.655 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.41 ' HB3' ' CG2' ' A' ' 12' ' ' THR . 6.5 p -45.63 132.62 8.36 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.27 -0.894 . . . . 0.0 109.947 179.219 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.445 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 6.4 t-20 -37.48 -42.45 0.52 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.61 -0.681 . . . . 0.0 111.825 -178.688 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.543 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -49.78 -46.29 50.58 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.24 -0.913 . . . . 0.0 110.217 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.412 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 33.0 m -66.75 -33.61 76.02 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.327 -0.858 . . . . 0.0 109.352 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.01 -38.61 95.66 Favored Glycine 0 N--CA 1.493 2.468 0 N-CA-C 109.156 -1.577 . . . . 0.0 109.156 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.52 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 95.2 mt -73.09 -58.01 3.62 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.526 -0.985 . . . . 0.0 110.045 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.422 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 29.6 t80 -46.14 -37.34 6.82 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.198 -0.938 . . . . 0.0 109.559 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.508 ' O ' ' N ' ' A' ' 39' ' ' GLN . 18.5 t80 -60.7 -55.42 33.4 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.37 -0.831 . . . . 0.0 110.413 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -57.29 -24.1 52.74 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.575 -1.328 . . . . 0.0 110.802 -179.556 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.475 HD12 ' HG3' ' A' ' 36' ' ' LYS . 5.7 mp -65.3 -67.19 0.46 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.345 -0.847 . . . . 0.0 109.823 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.519 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 66.1 m-70 -97.16 -29.5 13.56 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.295 -0.878 . . . . 0.0 110.395 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.519 ' CG ' ' O ' ' A' ' 38' ' ' HIS . 0.1 OUTLIER 87.4 27.5 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.571 0 CA-C-O 121.609 0.719 . . . . 0.0 110.574 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 m -124.63 -171.0 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.078 -1.014 . . . . 0.0 109.629 179.05 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -58.17 175.64 0.21 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.058 -1.027 . . . . 0.0 109.378 179.3 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.496 ' HD3' ' OD1' ' A' ' 9' ' ' ASN . 1.6 mpt_? -119.8 132.86 23.9 Favored Pre-proline 0 N--CA 1.495 1.804 0 O-C-N 120.909 -1.119 . . . . 0.0 109.805 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -62.8 126.32 17.9 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 C-N-CA 122.39 2.06 . . . . 0.0 110.965 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.465 ' HB3' ' HA ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -94.16 -19.72 20.52 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.422 -0.799 . . . . 0.0 110.123 179.521 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.22 -34.33 70.3 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.218 -0.926 . . . . 0.0 110.423 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -74.74 -29.81 61.29 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.243 -0.911 . . . . 0.0 109.482 179.506 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.505 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -64.16 141.75 58.66 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.365 -0.835 . . . . 0.0 109.34 179.795 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 tttt -104.42 178.27 4.61 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.282 -0.886 . . . . 0.0 110.15 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -74.94 -33.69 61.98 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.338 -0.852 . . . . 0.0 110.265 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -114.09 149.03 18.77 Favored Glycine 0 N--CA 1.497 2.757 0 N-CA-C 109.079 -1.609 . . . . 0.0 109.079 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.527 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.2 mt -46.35 107.77 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.545 -0.974 . . . . 0.0 110.128 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.404 ' O ' H5'' ' C' ' 124' ' ' ' DA' . 37.6 mt-30 -52.3 147.59 7.67 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.393 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.34 161.75 40.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.49 -1.381 . . . . 0.0 109.984 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.46 -152.37 0.43 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -60.02 114.31 2.77 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.808 -1.182 . . . . 0.0 107.944 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -47.17 133.71 11.59 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.665 -0.647 . . . . 0.0 109.864 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -50.11 106.9 0.13 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.414 HG13 ' H ' ' A' ' 58' ' ' VAL . 3.6 m -55.67 152.65 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.544 -0.722 . . . . 0.0 110.053 -178.783 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.77 74.88 0.6 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.435 -0.791 . . . . 0.0 109.579 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 N--CA 1.498 1.97 0 O-C-N 121.309 -0.87 . . . . 0.0 109.262 179.899 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.555 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.445 1.931 0 O4'-C1'-N19 110.818 3.772 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.555 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.441 1.634 1 O4'-C1'-N19 111.44 4.55 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.583 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.019 1 O4'-C1'-N19 111.07 4.088 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.583 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.039 1 O4'-C1'-N19 111.347 4.434 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.539 ' C2 ' ' C2 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.732 1 O4'-C1'-N19 111.024 4.03 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.539 ' C2 ' ' C2 ' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.921 0 O4'-C1'-N19 110.83 3.787 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.41 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.028 1 O4'-C1'-N19 111.206 4.258 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.41 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.613 2.048 0 O4'-C1'-N19 110.72 3.651 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.649 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.968 1 O4'-C1'-N19 111.83 5.037 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.649 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.577 1 O4'-C1'-N19 112.275 5.594 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.405 " O5'" H2'' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.16 1 O4'-C1'-N19 112.164 5.455 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.502 ' OP2' ' HB2' ' A' ' 34' ' ' TYR . . . . . . . . 0 C5'--C4' 1.529 2.236 0 O4'-C1'-N19 110.54 3.426 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.956 ' OP2' ' HB2' ' A' ' 30' ' ' ALA . . . . . . . . 0 O4'--C1' 1.445 1.922 1 O4'-C1'-N19 111.476 4.595 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.612 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.527 1.981 1 O4'-C1'-N19 112.11 5.387 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.556 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.642 0 O4'-C1'-N19 110.852 3.815 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.428 ' H71' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.908 0 O4'-C1'-N19 110.688 3.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.712 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 -90.21 59.82 4.57 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.41 -0.806 . . . . 0.0 109.76 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.49 140.53 58.61 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.324 -0.86 . . . . 0.0 109.419 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.79 -30.38 9.84 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.221 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.442 HG22 ' CH2' ' A' ' 18' ' ' TRP . 92.7 m -72.61 89.1 1.29 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.188 -1.183 . . . . 0.0 109.579 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 6' ' ' VAL . 32.7 m -85.61 122.13 38.04 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 53.4 t -56.02 113.9 1.71 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.932 -1.105 . . . . 0.0 110.05 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -60.8 -12.96 12.41 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.366 -0.833 . . . . 0.0 111.24 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -99.13 -31.22 11.86 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.82 -1.175 . . . . 0.0 110.702 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 15.0 p -139.42 24.26 2.48 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.56 -1.338 . . . . 0.0 111.424 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 43.04 23.9 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.215 -0.928 . . . . 0.0 112.71 178.593 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.462 ' H ' ' HB3' ' A' ' 7' ' ' CYS . 5.5 t -86.83 132.1 33.93 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.373 -1.454 . . . . 0.0 110.236 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.35 -25.62 19.31 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.4 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.6 p -97.39 117.58 31.94 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.326 -0.859 . . . . 0.0 109.374 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.456 HG21 ' CH2' ' A' ' 18' ' ' TRP . 18.0 p -132.43 156.04 47.42 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.157 -0.965 . . . . 0.0 111.004 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.666 HG21 " H3'" ' C' ' 124' ' ' ' DA' . 28.6 p -83.22 -40.93 18.99 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.596 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 16.6 mt -139.56 92.36 2.56 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 179.475 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.456 ' CH2' HG21 ' A' ' 15' ' ' THR . 10.5 m95 -57.6 127.97 34.72 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.195 -0.94 . . . . 0.0 110.148 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -116.16 86.07 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.379 -0.826 . . . . 0.0 109.122 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.46 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 12.8 mmm180 -62.63 102.73 0.36 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.371 -0.831 . . . . 0.0 109.314 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.481 ' HB2' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -63.65 143.57 97.95 Favored Pre-proline 0 N--CA 1.498 1.941 0 O-C-N 121.165 -0.959 . . . . 0.0 110.263 -179.292 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -53.99 -44.01 53.11 Favored 'Trans proline' 0 C--N 1.318 -1.03 0 C-N-CA 122.866 2.377 . . . . 0.0 111.26 -179.141 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -22.12 45.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.313 -0.867 . . . . 0.0 109.941 179.376 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.0 38.35 1.41 Allowed Glycine 0 N--CA 1.497 2.759 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 21' ' ' SER . 15.8 m-20 -128.51 98.21 26.13 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.324 -1.104 . . . . 0.0 110.082 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.497 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.9 Cg_endo -64.83 101.5 0.39 Allowed 'Trans proline' 0 C--N 1.311 -1.411 0 C-N-CA 121.956 1.771 . . . . 0.0 109.866 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.49 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -115.01 126.29 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.209 -0.932 . . . . 0.0 110.281 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.453 ' SG ' ' HB3' ' A' ' 30' ' ' ALA . 6.8 p -50.4 135.69 21.69 Favored 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.698 -0.626 . . . . 0.0 109.421 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.596 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t-20 -38.17 -43.81 0.8 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.564 -0.71 . . . . 0.0 111.384 -178.968 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.956 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -48.15 -45.31 33.12 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.525 -0.735 . . . . 0.0 110.359 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 51.3 m -70.3 -35.45 73.71 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.436 -0.79 . . . . 0.0 109.556 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.77 -31.73 81.87 Favored Glycine 0 N--CA 1.496 2.658 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.728 HD11 ' H62' ' C' ' 124' ' ' ' DA' . 96.8 mt -79.25 -61.22 2.08 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.248 -1.148 . . . . 0.0 110.079 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.578 ' CE2' ' HB2' ' A' ' 42' ' ' ARG . 33.1 t80 -50.79 -36.03 34.94 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.379 -0.826 . . . . 0.0 108.886 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.561 ' O ' ' N ' ' A' ' 39' ' ' GLN . 18.5 t80 -59.45 -53.68 55.34 Favored 'General case' 0 C--O 1.199 -1.559 0 O-C-N 121.54 -0.725 . . . . 0.0 109.669 179.26 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.639 ' HD3' HD12 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -55.02 -27.41 44.19 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 119.918 -1.739 . . . . 0.0 110.267 179.616 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.639 HD12 ' HD3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -66.57 -71.14 0.21 Allowed 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.896 -1.128 . . . . 0.0 109.92 179.614 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.445 ' HB2' HG22 ' A' ' 40' ' ' VAL . 25.1 m-70 -96.19 -28.6 14.48 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.204 -0.935 . . . . 0.0 109.56 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.561 ' N ' ' O ' ' A' ' 35' ' ' TYR . 21.5 tt0 73.3 52.43 0.13 Allowed 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 122.163 0.983 . . . . 0.0 110.336 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.3 m -141.34 170.49 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -78.54 126.04 30.2 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.814 -1.179 . . . . 0.0 109.981 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.578 ' HB2' ' CE2' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -102.57 131.86 21.94 Favored Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.037 -1.04 . . . . 0.0 109.77 -179.55 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.759 ' HB2' HG23 ' A' ' 45' ' ' THR . 1.0 OUTLIER -64.51 150.66 87.85 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.283 1.989 . . . . 0.0 110.334 178.967 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.484 ' HB3' ' O ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -84.67 30.77 0.55 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.002 -1.061 . . . . 0.0 110.406 179.699 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.759 HG23 ' HB2' ' A' ' 43' ' ' PRO . 33.8 p -70.68 -17.14 62.85 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.129 -0.982 . . . . 0.0 109.948 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.56 1.68 51.57 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.987 -1.071 . . . . 0.0 110.428 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.481 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -79.05 166.45 22.3 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 120.807 -1.183 . . . . 0.0 109.706 179.655 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 tptt -134.42 -172.55 3.04 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.36 -0.837 . . . . 0.0 109.469 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -59.85 -50.71 72.72 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.309 -0.869 . . . . 0.0 110.027 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.11 171.77 15.82 Favored Glycine 0 N--CA 1.494 2.501 0 N-CA-C 109.446 -1.462 . . . . 0.0 109.446 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.644 ' CG2' HG22 ' A' ' 16' ' ' THR . 5.3 mt -49.55 125.72 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.488 -1.007 . . . . 0.0 109.995 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.486 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.1 OUTLIER -71.25 154.81 41.36 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.554 -0.716 . . . . 0.0 110.203 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.466 ' HB ' ' OP1' ' C' ' 125' ' ' ' DT' . 0.1 OUTLIER -156.32 154.08 30.04 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.843 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.454 ' HG2' ' NH1' ' A' ' 54' ' ' ARG . 0.4 OUTLIER -151.67 -164.94 2.1 Favored 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -65.57 89.74 0.11 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.995 -1.066 . . . . 0.0 108.158 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.525 ' HD2' " O3'" ' C' ' 125' ' ' ' DT' . 0.5 OUTLIER -64.77 175.52 1.45 Allowed 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.564 0.697 . . . . 0.0 110.365 -178.903 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt -56.88 111.13 0.94 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.626 -0.671 . . . . 0.0 109.608 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.7 p -52.34 146.65 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.7 t -47.47 120.27 3.17 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.178 -0.952 . . . . 0.0 110.378 -179.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.1 t . . . . . 0 N--CA 1.496 1.875 0 O-C-N 121.702 -0.624 . . . . 0.0 110.082 -179.791 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.579 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.895 0 O4'-C1'-N19 110.521 3.401 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.579 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.875 1 O4'-C1'-N19 111.43 4.537 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.618 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.892 0 O4'-C1'-N19 110.892 3.865 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.618 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.805 1 O4'-C1'-N19 111.238 4.297 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.587 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.611 1.803 0 O4'-C1'-N19 110.64 3.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.795 0 O4'-C1'-N19 110.952 3.94 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.468 " O3'" ' HD3' ' A' ' 54' ' ' ARG . . . . . . . . 0 P--O5' 1.61 1.722 1 O4'-C1'-N19 111.4 4.5 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.814 0 O4'-C1'-N19 110.402 3.252 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.661 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.927 0 O4'-C1'-N19 110.831 3.789 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.661 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.615 1 O4'-C1'-N19 111.945 5.181 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.609 ' H71' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.165 1 O4'-C1'-N19 111.096 4.12 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.489 ' C7 ' HD13 ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.339 0 O4'-C1'-N19 110.633 3.541 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.579 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.473 0 O4'-C1'-N19 110.541 3.427 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.64 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.415 1 O4'-C1'-N19 112.651 6.064 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.517 " H2'" ' C5 ' ' C' ' 127' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.62 0 O4'-C1'-N19 110.828 3.785 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.517 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.899 0 O4'-C1'-N19 110.894 3.868 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.8 tttt . . . . . 0 N--CA 1.498 1.962 0 CA-C-O 121.053 0.454 . . . . 0.0 110.349 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.479 ' NE ' ' HA ' ' A' ' 2' ' ' ARG . 1.4 mmp_? -100.59 -13.57 18.54 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.919 -1.113 . . . . 0.0 109.916 179.303 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.26 111.21 3.86 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.1 -1.0 . . . . 0.0 108.986 179.321 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.22 -14.77 6.52 Favored Glycine 0 N--CA 1.497 2.729 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 -179.082 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.658 HG23 ' HB2' ' A' ' 26' ' ' PRO . 4.3 m -62.81 89.36 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.085 -1.244 . . . . 0.0 109.631 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 6' ' ' VAL . 35.0 m -82.48 114.27 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.539 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 45.3 t -49.35 110.08 0.33 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.253 -0.904 . . . . 0.0 110.468 -178.701 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.2 m -60.37 -13.22 11.99 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.171 -0.955 . . . . 0.0 111.149 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.519 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 1.0 OUTLIER -92.54 -30.96 15.39 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.822 -1.174 . . . . 0.0 110.69 -179.654 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.519 ' SG ' ' HD2' ' A' ' 47' ' ' ARG . 16.9 p -141.82 24.87 2.0 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.932 -1.105 . . . . 0.0 111.175 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 42.67 27.61 0.1 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.308 -0.87 . . . . 0.0 112.229 179.085 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.509 HG22 ' CB ' ' A' ' 7' ' ' CYS . 6.9 t -89.88 127.49 36.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.657 -1.277 . . . . 0.0 109.975 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -90.71 -12.59 36.19 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.534 -0.729 . . . . 0.0 109.63 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.464 ' HB ' HG13 ' A' ' 51' ' ' ILE . 30.0 p -113.35 126.1 55.0 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.213 -0.93 . . . . 0.0 108.576 179.219 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.561 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 20.3 p -139.96 160.85 38.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.13 -0.981 . . . . 0.0 110.228 -179.238 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.64 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 44.6 p -91.67 -26.1 18.81 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.526 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.696 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 63.4 mt -144.09 87.45 1.9 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 179.506 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.561 ' CZ3' HG21 ' A' ' 15' ' ' THR . 6.0 m95 -57.44 106.72 0.36 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.075 -1.016 . . . . 0.0 110.543 -179.327 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.0 92.39 4.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.328 -0.858 . . . . 0.0 109.559 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.51 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 2.0 tmt_? -72.76 126.53 30.13 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.118 -0.989 . . . . 0.0 109.729 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.0 t -90.17 140.42 27.31 Favored Pre-proline 0 N--CA 1.497 1.906 0 O-C-N 121.334 -0.854 . . . . 0.0 109.782 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -55.89 -36.04 94.97 Favored 'Trans proline' 0 C--N 1.32 -0.944 0 C-N-CA 122.582 2.188 . . . . 0.0 110.908 -179.563 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.4 ttt -51.45 -24.9 5.51 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.517 -0.739 . . . . 0.0 109.833 178.906 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 24' ' ' GLY . . . . . 0.441 ' HA2' ' CZ ' ' A' ' 20' ' ' ARG . . . 111.22 28.51 3.8 Favored Glycine 0 N--CA 1.496 2.673 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 179.892 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -133.48 104.76 12.09 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.21 -1.17 . . . . 0.0 110.419 -179.574 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.658 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.8 Cg_endo -64.0 117.88 4.86 Favored 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.127 1.885 . . . . 0.0 109.66 178.674 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.539 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -127.58 125.24 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.055 -1.028 . . . . 0.0 110.64 -179.625 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.448 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 8.0 p -51.53 131.61 29.49 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 179.261 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.696 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 23.8 t-20 -39.63 -38.5 0.62 Allowed 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.633 -0.667 . . . . 0.0 111.34 -178.931 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.435 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -51.23 -43.27 61.42 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.255 -0.903 . . . . 0.0 110.279 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.519 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 12.5 m -66.92 -44.6 80.31 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.126 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.54 -31.28 77.1 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 179.128 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.489 HD13 ' C7 ' ' C' ' 123' ' ' ' DT' . 48.5 mt -72.83 -67.61 0.55 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.331 -1.1 . . . . 0.0 110.047 -179.564 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.409 ' CE1' ' CD2' ' A' ' 38' ' ' HIS . 62.4 t80 -49.6 -35.01 19.47 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.399 -0.813 . . . . 0.0 109.638 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.537 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 13.1 t80 -61.5 -51.45 68.6 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.389 -0.819 . . . . 0.0 109.877 179.439 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -55.02 -26.34 36.5 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.28 -1.512 . . . . 0.0 110.567 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.447 HD22 ' OP2' ' C' ' 122' ' ' ' DT' . 5.0 mp -72.96 -65.16 0.83 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.098 -1.001 . . . . 0.0 110.719 -179.308 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.492 ' HB2' HG22 ' A' ' 40' ' ' VAL . 26.2 m-70 -97.76 -27.19 14.44 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.325 -0.859 . . . . 0.0 110.213 -179.471 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.537 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 77.22 31.75 0.48 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-O 121.652 0.739 . . . . 0.0 110.779 179.876 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.6 m -121.33 175.7 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 120.911 -1.118 . . . . 0.0 109.48 178.564 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -60.82 167.92 2.57 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.164 -0.96 . . . . 0.0 110.395 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.463 ' HD3' ' HD2' ' A' ' 43' ' ' PRO . 6.5 tpp180 -135.57 103.9 10.17 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.04 -1.038 . . . . 0.0 109.462 179.907 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.463 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 6.1 Cg_exo -57.26 137.84 83.51 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 C-N-CA 122.095 1.863 . . . . 0.0 110.229 179.657 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.554 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -79.56 6.94 9.22 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.428 -0.795 . . . . 0.0 111.013 -179.608 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.7 p -56.97 -20.32 23.1 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.979 -1.075 . . . . 0.0 110.392 179.252 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -82.55 -10.04 59.15 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.949 -1.095 . . . . 0.0 110.111 179.239 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.554 ' HG3' ' HB2' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -80.42 155.91 26.89 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.88 -1.138 . . . . 0.0 109.651 -179.971 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.433 ' HA ' ' HD2' ' A' ' 48' ' ' LYS . 5.5 mmmt -125.39 -156.86 0.75 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.216 -0.928 . . . . 0.0 109.489 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -51.25 -53.08 38.83 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.174 -0.954 . . . . 0.0 109.719 179.801 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -139.91 -168.32 11.29 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 179.533 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.464 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.1 mt -53.75 125.36 7.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.403 -1.057 . . . . 0.0 110.063 179.92 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -66.32 142.69 57.56 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.409 -0.807 . . . . 0.0 109.427 179.322 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.39 164.22 36.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.991 -1.068 . . . . 0.0 109.771 179.578 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.468 ' HD3' " O3'" ' B' ' 112' ' ' ' DA' . 0.0 OUTLIER -151.79 -165.44 2.23 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -179.59 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -54.27 116.27 2.52 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.052 -1.03 . . . . 0.0 108.712 179.107 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -45.05 135.64 5.29 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.585 -0.697 . . . . 0.0 110.607 -178.9 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -62.16 145.47 53.36 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.43 -0.793 . . . . 0.0 109.915 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.3 t -60.9 147.42 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.513 -0.742 . . . . 0.0 109.803 179.772 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.3 152.56 10.93 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.488 -0.757 . . . . 0.0 110.226 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 p . . . . . 0 N--CA 1.494 1.771 0 O-C-N 121.34 -0.85 . . . . 0.0 110.411 -179.451 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.597 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.614 2.14 0 O4'-C1'-N19 110.711 3.639 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.597 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.87 1 O4'-C1'-N19 112.025 5.282 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.616 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.217 1 O4'-C1'-N19 111.146 4.182 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.616 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.122 1 O4'-C1'-N19 111.23 4.288 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.558 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.798 0 O4'-C1'-N19 110.885 3.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.419 " O5'" H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.793 0 O4'-C1'-N19 110.995 3.994 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.816 1 O4'-C1'-N19 111.438 4.548 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.437 ' OP1' ' HD3' ' A' ' 54' ' ' ARG . . . . . . . . 0 P--O5' 1.611 1.844 0 O4'-C1'-N19 110.473 3.342 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.669 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.963 1 O4'-C1'-N19 111.336 4.42 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.669 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.649 1 O4'-C1'-N19 111.869 5.087 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.544 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.559 1 O4'-C1'-N19 111.411 4.513 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.513 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.185 0 O4'-C1'-N19 110.511 3.389 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.483 ' OP2' ' HB2' ' A' ' 30' ' ' ALA . . . . . . . . 0 C5'--C4' 1.534 2.863 0 O4'-C1'-N19 110.468 3.334 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.641 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.471 1 O4'-C1'-N19 112.566 5.958 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.506 " H2'" ' C5 ' ' C' ' 127' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.767 0 O4'-C1'-N19 110.78 3.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.506 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.471 0 O4'-C1'-N19 110.896 3.871 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.811 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 . . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.34 43.77 1.16 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.027 -1.046 . . . . 0.0 109.617 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.3 153.76 14.75 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.36 -0.838 . . . . 0.0 109.645 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.99 -40.37 2.54 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.239 -1.944 . . . . 0.0 108.239 -178.539 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.531 HG23 ' CB ' ' A' ' 26' ' ' PRO . 54.4 m -80.63 89.21 5.7 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.381 -1.07 . . . . 0.0 109.471 179.043 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.1 m -101.59 131.26 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 33.6 t -47.63 114.98 1.0 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.544 -0.722 . . . . 0.0 111.0 -179.122 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.1 m -59.69 -13.48 10.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.087 -1.008 . . . . 0.0 110.323 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -102.51 -32.06 10.12 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.822 -1.174 . . . . 0.0 110.931 -179.814 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.479 ' HB2' ' HA ' ' A' ' 44' ' ' LEU . 13.0 p -140.63 23.34 2.3 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.602 -1.312 . . . . 0.0 111.581 -179.532 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 38.75 29.45 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.495 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 178.675 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.523 HG23 HG22 ' A' ' 15' ' ' THR . 15.3 t -86.69 132.7 33.8 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.669 -1.269 . . . . 0.0 109.403 178.981 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.4 p -89.31 -28.83 19.6 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.565 -0.709 . . . . 0.0 109.34 179.745 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.402 ' HB ' HG13 ' A' ' 51' ' ' ILE . 23.2 p -90.18 108.36 19.7 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.839 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.743 ' C ' HD11 ' A' ' 51' ' ' ILE . 14.6 p -127.08 144.36 51.05 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.161 -0.962 . . . . 0.0 109.937 -179.527 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.641 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 30.9 p -65.96 -36.27 82.87 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.122 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.533 HD22 ' N7 ' ' B' ' 106' ' ' ' DA' . 12.9 mt -149.08 120.31 7.81 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.055 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.571 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.6 m95 -73.6 95.32 2.28 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.454 -0.779 . . . . 0.0 109.808 -179.452 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 77.11 2.3 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.403 -0.811 . . . . 0.0 108.82 179.629 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.5 mmt180 -61.19 95.3 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.454 -0.779 . . . . 0.0 109.059 -179.795 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.2 144.31 94.69 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.394 -0.816 . . . . 0.0 109.967 -179.162 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -58.69 -20.91 53.18 Favored 'Trans proline' 0 C--N 1.32 -0.973 0 C-N-CA 122.47 2.113 . . . . 0.0 110.672 179.85 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.8 0.04 25.31 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.18 -0.95 . . . . 0.0 109.9 178.978 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.66 32.57 15.15 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 109.433 -1.467 . . . . 0.0 109.433 -179.48 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -129.51 96.59 26.93 Favored Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 121.443 -1.034 . . . . 0.0 110.553 -179.232 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' CB ' HG23 ' A' ' 5' ' ' THR . 2.6 Cg_endo -64.16 111.38 1.58 Allowed 'Trans proline' 0 C--N 1.314 -1.244 0 C-N-CA 122.223 1.949 . . . . 0.0 110.172 178.89 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.494 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -121.45 124.77 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.418 -0.801 . . . . 0.0 110.078 179.896 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.444 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 5.0 p -48.46 135.7 13.76 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.589 -0.694 . . . . 0.0 109.886 179.663 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.515 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 4.6 t-20 -37.04 -44.51 0.53 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.62 -0.675 . . . . 0.0 112.2 -178.608 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.483 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -49.66 -51.92 34.64 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.421 -0.8 . . . . 0.0 110.235 -179.703 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 63.6 m -63.63 -39.54 94.6 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.301 -0.875 . . . . 0.0 109.537 179.665 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.0 -36.13 91.8 Favored Glycine 0 N--CA 1.498 2.806 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 179.663 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.449 HD11 ' H62' ' C' ' 124' ' ' ' DA' . 85.7 mt -73.21 -66.55 0.67 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.395 -1.062 . . . . 0.0 109.985 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.826 ' HA ' HD22 ' A' ' 37' ' ' LEU . 8.3 t80 -49.11 -40.44 32.18 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.235 -0.916 . . . . 0.0 109.114 179.628 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.465 ' O ' ' N ' ' A' ' 39' ' ' GLN . 38.2 t80 -51.0 -48.63 61.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.633 -0.667 . . . . 0.0 109.405 179.486 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.39 -38.46 87.57 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.065 -1.022 . . . . 0.0 110.248 179.617 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.826 HD22 ' HA ' ' A' ' 34' ' ' TYR . 5.1 mp -41.08 -51.37 3.37 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.507 -0.745 . . . . 0.0 110.197 -179.577 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.664 ' HB2' HG22 ' A' ' 40' ' ' VAL . 4.1 m-70 -127.91 17.73 6.74 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.27 -0.893 . . . . 0.0 109.555 179.298 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.465 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.3 OUTLIER 47.22 46.77 16.66 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.817 0.817 . . . . 0.0 109.597 -178.989 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.664 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.8 m -133.6 164.36 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 O-C-N 121.41 -0.806 . . . . 0.0 109.963 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -77.97 163.06 26.3 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.431 -0.793 . . . . 0.0 110.351 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.614 ' HB2' ' CD1' ' A' ' 34' ' ' TYR . 4.4 tpt180 -130.14 121.02 19.44 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.222 -0.924 . . . . 0.0 109.222 179.289 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.02 147.0 91.82 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 C-N-CA 121.925 1.75 . . . . 0.0 110.432 179.807 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.479 ' HA ' ' HB2' ' A' ' 10' ' ' CYS . 1.7 pt? -63.08 -10.99 16.62 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.442 -0.786 . . . . 0.0 110.921 179.588 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.9 t -48.73 -31.07 6.32 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.208 -0.933 . . . . 0.0 110.824 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.3 ttt -80.68 -39.66 26.83 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.162 -0.961 . . . . 0.0 109.426 179.656 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.486 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.8 OUTLIER -61.8 129.21 39.92 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.111 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.16 -149.56 0.36 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.281 -0.887 . . . . 0.0 109.685 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -50.63 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.433 -0.792 . . . . 0.0 110.899 -179.182 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.02 -168.45 13.1 Favored Glycine 0 N--CA 1.495 2.587 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 -179.752 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.743 HD11 ' C ' ' A' ' 15' ' ' THR . 13.9 mt -48.05 129.53 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.606 -0.938 . . . . 0.0 110.455 -179.772 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -76.36 78.68 3.11 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.3 -0.875 . . . . 0.0 109.861 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.47 161.15 26.25 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.401 -0.812 . . . . 0.0 109.638 179.591 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.437 ' HD3' ' OP1' ' B' ' 113' ' ' ' DC' . 0.4 OUTLIER -150.77 -153.63 0.5 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.61 -0.681 . . . . 0.0 109.767 -179.501 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -74.97 128.94 36.75 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.06 -1.025 . . . . 0.0 108.724 179.031 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.59 133.64 10.1 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.586 -0.696 . . . . 0.0 110.643 -179.349 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt -60.66 140.62 57.4 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.366 -0.834 . . . . 0.0 109.497 179.801 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.461 ' O ' HG13 ' A' ' 58' ' ' VAL . 10.3 p -65.06 122.5 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.095 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.16 109.2 0.62 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.16 -0.962 . . . . 0.0 108.808 -179.822 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.496 1.852 0 O-C-N 121.336 -0.852 . . . . 0.0 109.997 -179.087 . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.564 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.672 0 O4'-C1'-N19 110.532 3.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.564 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.524 1.564 1 O4'-C1'-N19 111.908 5.135 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.663 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.004 1 O4'-C1'-N19 111.089 4.112 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.663 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.704 0 O4'-C1'-N19 110.971 3.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.486 H2'' ' C8 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.752 0 O4'-C1'-N19 110.675 3.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.486 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.827 0 O4'-C1'-N19 110.858 3.822 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.452 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.807 1 O4'-C1'-N19 111.468 4.585 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.452 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.737 0 C3'-C2'-C1' 107.26 3.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.689 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.833 0 O4'-C1'-N19 110.887 3.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.689 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.572 1 O4'-C1'-N19 111.957 5.196 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.603 ' H71' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.376 0 O4'-C1'-N19 110.943 3.929 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.545 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.537 0 O4'-C1'-N19 110.61 3.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.601 " H2'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.529 2.235 1 O4'-C1'-N19 111.346 4.433 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.596 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.472 1 O4'-C1'-N19 112.059 5.324 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.475 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.728 0 O4'-C1'-N19 110.868 3.835 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.409 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.258 1 O4'-C1'-N19 111.364 4.455 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.1 tttm . . . . . 0 N--CA 1.498 1.931 0 CA-C-O 121.243 0.544 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.3 tpm_? -64.11 -25.18 67.98 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.001 -1.062 . . . . 0.0 109.155 179.253 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.1 129.44 39.98 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.447 -0.783 . . . . 0.0 108.982 178.908 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.53 -33.54 3.58 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 -179.058 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.594 HG23 ' HB2' ' A' ' 26' ' ' PRO . 27.2 m -62.77 90.75 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.32 -1.106 . . . . 0.0 108.787 178.95 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 6' ' ' VAL . 9.5 m -84.96 112.66 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.069 -1.019 . . . . 0.0 108.379 -179.975 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.505 ' O ' ' N ' ' A' ' 11' ' ' GLN . 44.8 t -47.45 113.7 0.74 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.428 -0.795 . . . . 0.0 109.917 -179.157 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 62.0 m -66.68 -12.56 58.86 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.021 -1.049 . . . . 0.0 111.001 -179.247 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.432 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 6.4 m-20 -89.62 -31.31 17.61 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.84 -1.162 . . . . 0.0 110.228 179.879 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.47 ' SG ' HG22 ' A' ' 12' ' ' THR . 16.8 p -140.46 17.4 2.38 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.887 -1.133 . . . . 0.0 111.057 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 7' ' ' CYS . 11.5 mt-30 51.49 21.2 1.19 Allowed 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.989 -1.069 . . . . 0.0 111.801 178.949 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.47 HG22 ' SG ' ' A' ' 10' ' ' CYS . 6.3 t -87.61 136.47 32.93 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.681 -1.262 . . . . 0.0 110.564 -179.724 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -27.12 18.93 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.302 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.517 HG21 ' HA2' ' A' ' 50' ' ' GLY . 18.6 p -90.06 127.09 35.99 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.416 -0.802 . . . . 0.0 109.537 179.527 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.696 HG21 ' CH2' ' A' ' 18' ' ' TRP . 10.3 p -145.69 144.09 30.18 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.409 -0.807 . . . . 0.0 110.225 -179.558 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.601 HG21 " H2'" ' C' ' 124' ' ' ' DA' . 20.2 p -72.63 -28.59 62.85 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.329 -0.857 . . . . 0.0 109.098 179.139 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.587 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -152.71 117.17 4.98 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.173 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.696 ' CH2' HG21 ' A' ' 15' ' ' THR . 8.0 m95 -73.82 108.81 6.87 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.183 -0.948 . . . . 0.0 110.09 -179.02 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -99.3 94.47 6.48 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.133 -0.979 . . . . 0.0 109.452 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.436 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.3 tpp180 -66.6 102.71 0.95 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 108.364 179.364 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -56.36 146.74 51.62 Favored Pre-proline 0 N--CA 1.5 2.052 0 O-C-N 121.388 -0.82 . . . . 0.0 110.209 -178.718 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -52.92 -43.91 52.82 Favored 'Trans proline' 0 C--N 1.319 -0.995 0 C-N-CA 122.702 2.268 . . . . 0.0 111.07 -179.05 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.6 ttp -57.59 -23.49 51.11 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.414 -0.804 . . . . 0.0 109.717 179.137 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.35 38.22 1.38 Allowed Glycine 0 N--CA 1.496 2.665 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' A' ' 21' ' ' SER . 60.5 m-20 -128.3 110.09 19.54 Favored Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.1 -1.236 . . . . 0.0 110.491 -179.841 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.594 ' HB2' HG23 ' A' ' 5' ' ' THR . 3.5 Cg_exo -62.92 109.86 1.01 Allowed 'Trans proline' 0 C--N 1.313 -1.313 0 C-N-CA 122.011 1.807 . . . . 0.0 110.062 178.627 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.417 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.1 m -121.56 131.38 73.21 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.163 -0.961 . . . . 0.0 110.407 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.471 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.8 p -55.03 132.55 47.4 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.663 -0.648 . . . . 0.0 109.305 179.556 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.587 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 16.7 t-20 -35.58 -46.09 0.39 Allowed 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.87 -0.519 . . . . 0.0 112.162 -178.313 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.497 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -50.77 -45.46 59.0 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.347 -0.845 . . . . 0.0 110.206 -179.688 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.432 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 19.4 m -65.53 -39.34 91.68 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.177 -0.952 . . . . 0.0 109.001 179.263 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.22 -43.39 95.45 Favored Glycine 0 N--CA 1.497 2.743 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.446 ' O ' HD13 ' A' ' 37' ' ' LEU . 46.6 mt -75.69 -57.46 3.87 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.454 -1.027 . . . . 0.0 109.698 -179.831 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.631 ' HA ' HD22 ' A' ' 37' ' ' LEU . 26.9 t80 -51.84 -38.56 56.39 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.512 -0.742 . . . . 0.0 109.046 179.475 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.478 ' O ' ' N ' ' A' ' 39' ' ' GLN . 44.8 t80 -56.35 -45.56 80.38 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 178.705 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.04 -39.4 93.29 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.066 -1.021 . . . . 0.0 109.899 179.319 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.631 HD22 ' HA ' ' A' ' 34' ' ' TYR . 5.8 mp -44.88 -59.12 2.71 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.562 -0.711 . . . . 0.0 110.128 -179.466 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.527 ' CB ' HG22 ' A' ' 40' ' ' VAL . 87.9 m-70 -104.14 4.64 34.34 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.45 -0.781 . . . . 0.0 109.415 178.828 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 49.7 33.83 6.62 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.565 -0.709 . . . . 0.0 110.027 -178.702 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.527 HG22 ' CB ' ' A' ' 38' ' ' HIS . 11.1 m -140.17 163.79 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 O-C-N 121.463 -0.773 . . . . 0.0 110.018 -179.612 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -82.17 140.97 33.44 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.335 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.551 ' HG3' ' CE2' ' A' ' 34' ' ' TYR . 2.3 mmm180 -127.99 150.39 73.5 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.014 -1.054 . . . . 0.0 110.09 -179.493 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -57.09 151.68 49.07 Favored 'Trans proline' 0 C--N 1.315 -1.211 0 C-N-CA 123.005 2.47 . . . . 0.0 111.814 -179.074 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.443 ' HB2' ' HD3' ' A' ' 47' ' ' ARG . 1.0 OUTLIER -71.57 10.18 0.7 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.594 -0.691 . . . . 0.0 111.568 179.793 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.02 -32.41 61.82 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.611 -1.305 . . . . 0.0 110.18 179.54 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.07 -12.78 49.24 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.399 -0.813 . . . . 0.0 110.346 179.515 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.443 ' HD3' ' HB2' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -58.71 162.11 4.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.903 -1.123 . . . . 0.0 109.965 179.822 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.28 149.76 46.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.458 -0.776 . . . . 0.0 109.456 178.895 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -63.81 -35.01 79.21 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.493 -0.754 . . . . 0.0 110.175 -179.862 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' GLY . . . . . 0.517 ' HA2' HG21 ' A' ' 14' ' ' THR . . . -134.53 157.0 22.73 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 179.318 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.552 HG23 HG22 ' A' ' 16' ' ' THR . 4.9 mt -53.31 119.5 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.157 -1.202 . . . . 0.0 109.987 -179.618 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.504 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -75.6 167.28 22.19 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.634 -0.666 . . . . 0.0 109.206 179.755 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.484 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -154.98 160.67 41.27 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.571 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.47 -161.66 1.39 Allowed 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -179.617 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.37 94.46 0.06 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.825 -1.172 . . . . 0.0 108.924 179.302 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.411 ' HB3' " H4'" ' C' ' 125' ' ' ' DT' . 5.1 ptp180 -54.49 143.84 22.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.483 -0.761 . . . . 0.0 109.97 -179.502 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -61.65 123.33 17.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.358 -0.839 . . . . 0.0 109.152 179.797 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 61.9 t -53.14 153.15 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.386 -0.821 . . . . 0.0 110.539 -179.231 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.3 m -64.88 169.31 5.31 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 121.396 0.617 . . . . 0.0 110.324 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.495 1.783 0 O-C-N 121.264 -0.897 . . . . 0.0 109.858 179.761 . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.527 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.688 0 O4'-C1'-N19 110.57 3.462 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.55 ' N7 ' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.441 1.582 1 O4'-C1'-N19 111.535 4.668 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.669 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.467 1 O4'-C1'-N19 111.424 4.529 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.669 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.544 1 O4'-C1'-N19 111.157 4.197 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.537 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.613 1.996 0 O4'-C1'-N19 110.697 3.621 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.087 0 O4'-C1'-N19 110.926 3.908 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.443 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.614 1 O4'-C1'-N19 111.454 4.568 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.443 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.704 0 O4'-C1'-N19 110.7 3.625 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.654 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.777 1 O4'-C1'-N19 111.166 4.208 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.654 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.527 1 O4'-C1'-N19 111.839 5.048 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.577 ' H71' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.035 1 O4'-C1'-N19 111.019 4.024 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.483 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.942 0 O4'-C1'-N19 110.544 3.429 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.543 ' N6 ' ' N6 ' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.295 0 O4'-C1'-N19 110.449 3.311 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.605 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.463 1 O4'-C1'-N19 112.453 5.816 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.5 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.611 0 O4'-C1'-N19 110.874 3.842 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.476 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.53 2.334 0 O4'-C1'-N19 110.923 3.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.814 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 . . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -81.26 -43.37 19.29 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.215 -0.928 . . . . 0.0 108.8 179.218 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.86 104.46 1.7 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.536 -0.728 . . . . 0.0 109.709 179.683 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.91 -18.23 12.68 Favored Glycine 0 N--CA 1.495 2.596 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.549 ' O ' HG22 ' A' ' 5' ' ' THR . 15.2 m -76.46 85.57 3.19 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.82 -1.4 . . . . 0.0 110.314 -179.789 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 m -85.77 120.37 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 178.18 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 51.5 t -45.46 111.55 0.35 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.206 -0.934 . . . . 0.0 110.202 -178.327 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 71.8 m -59.71 -14.31 13.64 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.171 -0.956 . . . . 0.0 111.437 -179.212 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.541 ' OD1' ' HD2' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -95.39 -30.83 13.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.634 -1.291 . . . . 0.0 110.734 -179.572 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.486 ' SG ' ' HD3' ' A' ' 47' ' ' ARG . 18.4 p -141.26 28.37 1.87 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.897 -1.127 . . . . 0.0 110.492 179.289 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.46 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 34.22 30.19 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.728 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 179.781 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.453 ' H ' ' HB3' ' A' ' 7' ' ' CYS . 5.1 t -90.88 132.56 35.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.747 -1.22 . . . . 0.0 109.844 179.479 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.2 p -90.29 -28.6 18.67 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.237 -0.914 . . . . 0.0 109.107 179.379 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.7 p -89.86 111.04 21.95 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.431 -0.793 . . . . 0.0 109.479 179.5 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.549 HG21 ' CH2' ' A' ' 18' ' ' TRP . 9.5 p -130.97 166.52 20.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.332 -0.855 . . . . 0.0 110.205 -179.712 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.605 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 16.2 p -89.41 -40.57 12.63 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.353 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 14.3 mt -141.89 112.56 7.22 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.321 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.549 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.0 m95 -69.67 88.72 0.53 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.304 -0.873 . . . . 0.0 109.608 -179.389 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.78 84.85 7.2 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.61 -0.682 . . . . 0.0 109.424 -179.913 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 9.3 tpp180 -62.17 120.83 11.67 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.113 -0.992 . . . . 0.0 109.213 179.726 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.59 144.01 68.84 Favored Pre-proline 0 N--CA 1.498 1.932 0 O-C-N 121.298 -0.876 . . . . 0.0 110.187 -179.439 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -56.45 -42.49 65.09 Favored 'Trans proline' 0 C--N 1.319 -1.014 0 C-N-CA 122.737 2.291 . . . . 0.0 111.197 -179.294 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -21.03 39.62 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.299 -0.875 . . . . 0.0 110.061 179.486 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.63 35.92 1.65 Allowed Glycine 0 N--CA 1.497 2.759 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -127.03 102.75 24.13 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.207 -1.172 . . . . 0.0 110.142 -179.796 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.494 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.6 Cg_endo -64.02 98.56 0.26 Allowed 'Trans proline' 0 C--N 1.312 -1.364 0 C-N-CA 122.162 1.908 . . . . 0.0 109.604 178.793 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.474 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.0 m -109.74 153.94 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 CA-C-O 122.348 1.07 . . . . 0.0 111.114 -179.622 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.467 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 15.3 p -81.48 138.72 35.47 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.433 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 4.7 t-20 -37.96 -37.24 0.24 Allowed 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.695 -0.628 . . . . 0.0 111.971 -178.799 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.44 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -64.39 -42.77 95.94 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.09 -1.006 . . . . 0.0 111.695 -179.329 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.508 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 4.9 m -61.52 -40.67 95.47 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.212 -0.93 . . . . 0.0 109.088 -179.934 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.4 -49.02 54.53 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.427 ' O ' HD13 ' A' ' 37' ' ' LEU . 94.8 mt -60.58 -58.41 8.6 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.638 -0.919 . . . . 0.0 109.63 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.624 ' CE1' ' HD2' ' A' ' 43' ' ' PRO . 20.4 t80 -54.51 -43.84 72.21 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.543 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.507 ' CD2' ' O ' ' A' ' 40' ' ' VAL . 20.0 t80 -51.91 -46.57 64.66 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.508 -0.745 . . . . 0.0 109.073 179.27 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -63.34 -41.92 98.9 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.214 -0.929 . . . . 0.0 110.152 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.568 HD22 ' HA ' ' A' ' 34' ' ' TYR . 3.9 mp -45.36 -59.28 2.76 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.329 -0.857 . . . . 0.0 110.427 -179.439 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.516 ' CB ' HG22 ' A' ' 40' ' ' VAL . 53.4 m-70 -102.61 6.42 39.71 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.374 -0.829 . . . . 0.0 109.853 179.565 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.448 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.6 OUTLIER 46.7 31.89 1.55 Allowed 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.51 -0.744 . . . . 0.0 110.299 -179.212 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.516 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.9 m -134.61 -161.47 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 O-C-N 121.476 -0.765 . . . . 0.0 109.048 179.652 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -59.1 -175.01 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.996 -1.065 . . . . 0.0 110.596 -179.883 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.541 ' HD2' ' OD1' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -141.1 102.91 6.17 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.106 -0.996 . . . . 0.0 109.969 -179.189 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.624 ' HD2' ' CE1' ' A' ' 34' ' ' TYR . 3.9 Cg_exo -60.62 126.05 18.87 Favored 'Trans proline' 0 C--N 1.315 -1.186 0 C-N-CA 121.991 1.794 . . . . 0.0 110.08 179.753 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.429 ' O ' HD12 ' A' ' 44' ' ' LEU . 1.3 pp -85.05 16.43 3.47 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.385 -0.822 . . . . 0.0 110.935 -179.836 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 p -68.45 -5.65 20.46 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.02 -1.05 . . . . 0.0 111.07 -179.917 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' MET . . . . . 0.422 ' HE1' " H4'" ' C' ' 122' ' ' ' DT' . 65.9 mtp -94.23 -26.79 16.49 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.883 -1.136 . . . . 0.0 110.144 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.486 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -65.25 154.4 38.25 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.215 -0.928 . . . . 0.0 110.264 179.994 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.36 -158.61 0.9 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.921 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.08 -39.1 84.9 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.288 -0.882 . . . . 0.0 109.693 179.384 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.07 -175.33 14.13 Favored Glycine 0 N--CA 1.5 2.931 0 N-CA-C 110.19 -1.164 . . . . 0.0 110.19 179.513 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.496 HG21 HG22 ' A' ' 16' ' ' THR . 3.8 mt -62.31 137.12 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.286 -1.126 . . . . 0.0 108.965 179.453 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.7 mt-30 -65.66 79.87 0.07 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.22 -0.925 . . . . 0.0 111.047 -178.638 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.06 159.54 15.43 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.137 -0.977 . . . . 0.0 110.4 179.564 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.64 -159.11 0.99 Allowed 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -52.56 103.15 0.06 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.833 -1.167 . . . . 0.0 109.159 179.208 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.5 ttm180 -50.74 140.8 14.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.369 -0.832 . . . . 0.0 110.339 -178.834 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.39 130.18 39.16 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.475 -0.766 . . . . 0.0 109.281 179.077 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -60.41 151.25 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.453 -0.78 . . . . 0.0 110.077 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.6 141.82 15.53 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.475 -0.765 . . . . 0.0 110.011 179.796 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.968 0 O-C-N 121.378 -0.826 . . . . 0.0 110.655 -179.515 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.542 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.72 0 O4'-C1'-N19 110.557 3.447 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.542 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.081 1 O4'-C1'-N19 111.932 5.165 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.599 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.959 0 O4'-C1'-N19 110.867 3.834 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.599 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.726 1 O4'-C1'-N19 111.266 4.333 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.535 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.922 0 O4'-C1'-N19 110.797 3.746 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.965 0 O4'-C1'-N19 110.787 3.734 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.442 1.723 1 O4'-C1'-N19 111.094 4.117 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.832 0 O4'-C1'-N19 110.449 3.311 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.571 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.725 0 O4'-C1'-N19 110.838 3.798 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.571 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.456 1 O4'-C1'-N19 111.784 4.98 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.504 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.412 0 O4'-C1'-N19 110.997 3.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.522 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.067 0 O4'-C1'-N19 110.655 3.569 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.523 " H2'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.325 0 O4'-C1'-N19 110.519 3.399 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.558 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.526 1.894 1 O4'-C1'-N19 112.383 5.728 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 025 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.517 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.763 0 O4'-C1'-N19 110.553 3.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.499 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.808 0 O4'-C1'-N19 110.922 3.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt . . . . . 0 N--CA 1.5 2.048 0 CA-C-O 120.822 0.344 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -78.19 -3.38 42.31 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.974 -1.079 . . . . 0.0 110.767 -179.82 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.84 109.7 2.58 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.146 -0.971 . . . . 0.0 109.384 179.315 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.25 -26.52 5.51 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.399 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.478 HG23 ' CB ' ' A' ' 26' ' ' PRO . 70.8 m -68.4 92.64 0.44 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.302 -1.117 . . . . 0.0 109.089 179.295 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -90.91 138.26 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.283 -0.886 . . . . 0.0 108.722 179.839 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.748 ' HB2' HG22 ' A' ' 12' ' ' THR . 24.6 t -62.42 118.08 7.02 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.146 -0.971 . . . . 0.0 110.973 -179.35 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 m -60.4 -15.47 26.52 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.387 -0.821 . . . . 0.0 110.295 178.85 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.673 ' OD1' HG11 ' A' ' 27' ' ' VAL . 9.0 m120 -102.82 -30.4 10.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.065 -1.022 . . . . 0.0 110.852 -179.764 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.493 ' SG ' ' HG3' ' A' ' 47' ' ' ARG . 12.8 p -142.66 23.43 1.94 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.672 -1.268 . . . . 0.0 111.909 -179.306 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 38.25 37.5 0.16 Allowed 'General case' 0 N--CA 1.511 2.597 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 178.483 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.748 HG22 ' HB2' ' A' ' 7' ' ' CYS . 5.3 t -88.14 135.13 33.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.527 -1.358 . . . . 0.0 108.694 178.333 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.4 p -90.44 -10.79 42.45 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.159 -0.963 . . . . 0.0 109.736 179.922 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.422 ' HB ' HG13 ' A' ' 51' ' ' ILE . 34.7 p -121.26 132.53 54.86 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.217 -0.927 . . . . 0.0 108.697 178.926 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 6.5 p -145.74 157.18 43.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.411 -0.806 . . . . 0.0 109.668 -179.811 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.558 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 18.4 p -77.93 -35.63 50.24 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.281 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.522 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.6 mt -146.53 106.58 4.0 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.599 -0.688 . . . . 0.0 109.486 179.638 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.43 ' CH2' HG22 ' A' ' 5' ' ' THR . 13.6 m95 -65.3 111.69 3.13 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.555 -0.715 . . . . 0.0 110.497 -179.372 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.29 72.07 5.3 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.242 -0.911 . . . . 0.0 109.126 179.276 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.51 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.9 OUTLIER -61.98 110.49 1.58 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.204 -0.935 . . . . 0.0 109.277 -179.965 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.421 ' OG ' ' HD2' ' A' ' 22' ' ' PRO . 0.1 OUTLIER -75.2 154.2 86.3 Favored Pre-proline 0 N--CA 1.497 1.905 0 O-C-N 121.298 -0.876 . . . . 0.0 110.036 -179.705 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 22' ' ' PRO . . . . . 0.421 ' HD2' ' OG ' ' A' ' 21' ' ' SER . 4.7 Cg_exo -53.39 -48.14 23.57 Favored 'Trans proline' 0 C--N 1.319 -1.017 0 C-N-CA 122.762 2.308 . . . . 0.0 111.407 -178.943 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.0 -21.58 59.21 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.341 -0.849 . . . . 0.0 110.05 179.503 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.44 50.59 0.65 Allowed Glycine 0 N--CA 1.496 2.689 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 -179.81 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -127.46 89.58 50.91 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.574 -0.956 . . . . 0.0 109.994 -179.377 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.51 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 1.4 Cg_endo -66.4 94.51 0.31 Allowed 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 122.299 1.999 . . . . 0.0 110.0 179.434 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.673 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.4 m -109.69 125.86 66.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.06 -1.025 . . . . 0.0 110.52 -179.833 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.563 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 5.2 p -49.98 134.26 21.69 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.674 -0.641 . . . . 0.0 110.07 179.786 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.522 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 1.7 t-20 -36.77 -47.74 0.69 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.876 -0.515 . . . . 0.0 111.519 -178.952 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.39 -46.2 25.86 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.43 -0.794 . . . . 0.0 110.578 -179.66 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 27.0 m -66.34 -43.8 85.08 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.21 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.51 -32.17 68.27 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 110.114 -1.194 . . . . 0.0 110.114 179.069 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 33' ' ' LEU . 61.0 mt -79.53 -62.29 1.74 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.334 -1.098 . . . . 0.0 109.844 179.905 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -50.99 -36.73 40.72 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.292 -0.88 . . . . 0.0 108.79 179.346 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.512 ' O ' ' N ' ' A' ' 39' ' ' GLN . 31.0 t80 -61.88 -46.49 89.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.45 -0.781 . . . . 0.0 109.712 179.298 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -22.03 57.96 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.259 -1.525 . . . . 0.0 110.079 179.457 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.1 mp -74.54 -71.82 0.32 Allowed 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.976 -1.078 . . . . 0.0 109.851 179.836 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.452 ' HB2' HG22 ' A' ' 40' ' ' VAL . 51.7 m-70 -93.95 -18.81 21.53 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.309 -0.869 . . . . 0.0 110.477 -179.901 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.512 ' N ' ' O ' ' A' ' 35' ' ' TYR . 2.3 tt0 61.54 53.36 3.36 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-O 122.192 0.996 . . . . 0.0 109.951 -179.897 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.452 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.6 m -138.51 168.08 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.185 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.403 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 9.7 p-10 -70.24 126.15 28.83 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.813 -1.179 . . . . 0.0 109.337 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.414 ' CD ' ' HD2' ' A' ' 43' ' ' PRO . 5.4 tpt180 -96.62 110.53 53.53 Favored Pre-proline 0 N--CA 1.493 1.706 0 O-C-N 121.205 -0.934 . . . . 0.0 109.735 -179.444 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.414 ' HD2' ' CD ' ' A' ' 42' ' ' ARG . 6.2 Cg_exo -56.15 147.21 66.63 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 C-N-CA 121.976 1.784 . . . . 0.0 110.408 179.272 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.406 ' HB2' ' HD2' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -71.27 7.73 1.22 Allowed 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.429 -0.794 . . . . 0.0 111.615 -179.795 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -50.25 -30.68 12.26 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.905 -1.122 . . . . 0.0 109.933 179.232 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.0 ttp -103.56 -24.13 13.44 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.342 -0.849 . . . . 0.0 110.227 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.496 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -59.22 143.52 48.81 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.152 -0.967 . . . . 0.0 109.92 -179.858 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HB2' ' OE1' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -123.39 157.21 33.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.261 -0.899 . . . . 0.0 109.709 179.587 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -71.37 -29.71 65.28 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.599 -0.688 . . . . 0.0 110.323 -179.596 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -111.71 132.6 10.95 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 179.548 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.422 HG13 ' HB ' ' A' ' 14' ' ' THR . 4.9 mt -51.04 125.11 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.724 -0.868 . . . . 0.0 110.63 -179.783 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.465 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -73.72 157.17 37.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.609 -0.682 . . . . 0.0 109.61 179.24 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.06 164.15 38.25 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.01 -1.056 . . . . 0.0 109.825 179.201 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.92 -158.79 0.95 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.587 -0.696 . . . . 0.0 109.383 -179.677 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -55.83 98.47 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.899 -1.126 . . . . 0.0 108.961 179.215 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -49.99 139.74 13.38 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.499 -0.751 . . . . 0.0 110.818 -178.602 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.22 126.23 30.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.584 -0.698 . . . . 0.0 109.432 179.455 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 34.4 m -71.51 -167.17 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.361 -0.837 . . . . 0.0 109.575 179.577 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.411 ' CB ' ' OP1' ' C' ' 127' ' ' ' DT' . 85.5 p -88.35 147.25 24.85 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.052 -1.03 . . . . 0.0 110.292 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 30.8 t . . . . . 0 N--CA 1.496 1.838 0 O-C-N 121.152 -0.967 . . . . 0.0 109.276 179.771 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.665 ' N7 ' HD22 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.527 1.987 0 O4'-C1'-N19 110.855 3.819 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.504 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.394 1 O4'-C1'-N19 111.25 4.313 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.703 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.702 1 O4'-C1'-N19 111.006 4.007 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.703 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.661 0 O4'-C1'-N19 110.948 3.935 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.543 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.191 0 O4'-C1'-N19 110.925 3.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.417 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.877 0 O4'-C1'-N19 110.881 3.852 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.417 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.442 1.718 1 O4'-C1'-N19 111.356 4.445 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.036 0 O4'-C1'-N19 110.603 3.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.646 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.614 1 O4'-C1'-N19 111.59 4.738 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.646 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.427 1 O4'-C1'-N19 111.932 5.165 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.466 ' C4 ' ' N3 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.795 1 O4'-C1'-N19 112.35 5.688 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.517 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.142 0 O4'-C1'-N19 110.868 3.834 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.673 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.535 3.061 1 O4'-C1'-N19 111.259 4.323 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.52 H2'' ' C6 ' ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.285 1 O4'-C1'-N19 112.338 5.672 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.52 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.535 2.967 0 O4'-C1'-N19 110.572 3.465 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.506 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.443 0 O4'-C1'-N19 110.845 3.806 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.099 0 N-CA-C 110.156 -0.312 . . . . 0.0 110.156 . . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.06 12.23 5.31 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.976 -1.077 . . . . 0.0 110.211 179.159 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.95 115.56 4.51 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.934 -1.103 . . . . 0.0 108.865 179.359 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.95 -11.23 6.96 Favored Glycine 0 N--CA 1.497 2.726 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 -179.192 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.46 HG22 ' CH2' ' A' ' 18' ' ' TRP . 93.9 m -65.45 88.53 0.09 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.071 -1.253 . . . . 0.0 109.626 179.702 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 6' ' ' VAL . 24.9 m -88.53 112.08 23.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 179.16 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.551 ' CB ' HG22 ' A' ' 12' ' ' THR . 52.7 t -46.88 113.36 0.65 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.277 -0.889 . . . . 0.0 110.071 -178.486 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.1 m -61.17 -14.81 27.82 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.359 -0.838 . . . . 0.0 111.073 -179.484 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.427 ' CB ' ' SG ' ' A' ' 31' ' ' CYS . 12.1 m-20 -94.76 -30.09 14.43 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.863 -1.148 . . . . 0.0 110.988 -179.485 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.596 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 18.5 p -139.66 19.84 2.52 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.56 -1.338 . . . . 0.0 111.383 179.598 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 7' ' ' CYS . 3.9 mt-30 45.81 26.17 0.35 Allowed 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.233 -0.917 . . . . 0.0 111.97 179.014 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.551 HG22 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -84.94 136.7 33.51 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.709 -1.244 . . . . 0.0 109.977 179.684 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 p -93.48 1.54 56.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.565 -0.71 . . . . 0.0 109.427 178.89 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.466 ' HB ' HG13 ' A' ' 51' ' ' ILE . 79.2 p -127.42 130.9 50.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.047 -1.033 . . . . 0.0 110.111 -179.606 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.699 ' C ' HD11 ' A' ' 51' ' ' ILE . 9.3 p -147.89 143.03 27.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.443 -0.786 . . . . 0.0 109.771 179.625 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.673 HG21 " H3'" ' C' ' 124' ' ' ' DA' . 44.6 p -72.12 -33.57 67.91 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 178.791 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.665 HD22 ' N7 ' ' B' ' 106' ' ' ' DA' . 69.3 mt -142.39 105.54 4.59 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.067 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.603 ' CZ3' HG21 ' A' ' 15' ' ' THR . 12.5 m95 -64.77 86.34 0.05 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.418 -0.802 . . . . 0.0 109.656 -179.877 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.33 81.39 0.37 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 109.73 -179.795 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HD3' ' CA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.96 101.45 0.21 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.073 -1.017 . . . . 0.0 108.766 179.517 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.93 141.72 47.45 Favored Pre-proline 0 N--CA 1.497 1.894 0 O-C-N 121.411 -0.806 . . . . 0.0 109.997 -179.034 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -53.88 -36.21 82.44 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 122.504 2.136 . . . . 0.0 110.962 -179.318 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 23' ' ' MET . . . . . 0.45 ' HA ' ' CE ' ' A' ' 23' ' ' MET . 1.1 tpt -60.03 -22.21 62.35 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.365 -0.834 . . . . 0.0 109.871 179.318 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.92 33.25 2.05 Favored Glycine 0 N--CA 1.497 2.722 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.659 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -126.09 113.0 24.07 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.172 -1.193 . . . . 0.0 110.42 -179.557 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.473 ' CA ' ' HD3' ' A' ' 20' ' ' ARG . 3.2 Cg_exo -64.1 100.1 0.3 Allowed 'Trans proline' 0 C--N 1.316 -1.174 0 C-N-CA 122.313 2.009 . . . . 0.0 110.083 178.879 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.5 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -119.88 127.17 75.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.126 -0.984 . . . . 0.0 110.149 179.947 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.478 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 8.3 p -51.43 136.54 25.44 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.479 -0.763 . . . . 0.0 109.397 179.331 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -43.36 -43.42 5.08 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.418 -0.801 . . . . 0.0 111.611 -178.252 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.34 -44.38 34.27 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.255 -0.903 . . . . 0.0 110.287 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.427 ' SG ' ' CB ' ' A' ' 9' ' ' ASN . 5.4 m -63.69 -43.67 95.94 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.342 -0.849 . . . . 0.0 109.229 179.235 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.4 -57.18 15.97 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 110.35 -1.1 . . . . 0.0 110.35 -179.859 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.406 ' HB3' ' H71' ' C' ' 123' ' ' ' DT' . 16.9 mt -60.77 -55.79 28.97 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.452 -1.028 . . . . 0.0 109.357 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.454 ' OH ' ' HG3' ' A' ' 42' ' ' ARG . 75.0 t80 -49.95 -43.88 50.23 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.613 -0.68 . . . . 0.0 109.597 179.498 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -56.17 -45.93 79.53 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.301 -0.874 . . . . 0.0 109.285 179.388 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.36 -30.94 71.54 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.095 -1.003 . . . . 0.0 110.142 179.435 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 34' ' ' TYR . 4.7 mp -61.73 -65.62 0.66 Allowed 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.098 -1.001 . . . . 0.0 110.625 -179.608 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.829 ' O ' HG22 ' A' ' 40' ' ' VAL . 59.8 m-70 -95.59 9.32 40.61 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.221 -0.924 . . . . 0.0 110.532 -179.66 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER 41.08 32.51 0.18 Allowed 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.519 -0.738 . . . . 0.0 111.424 -179.182 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.829 HG22 ' O ' ' A' ' 38' ' ' HIS . 4.5 m -145.57 169.77 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 121.281 -0.887 . . . . 0.0 109.807 179.759 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -85.85 154.23 21.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.262 -0.898 . . . . 0.0 109.368 178.899 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.454 ' HG3' ' OH ' ' A' ' 34' ' ' TYR . 30.0 mmt180 -149.98 151.18 31.69 Favored Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 121.061 -1.024 . . . . 0.0 109.77 179.519 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -59.33 147.51 90.7 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 C-N-CA 122.205 1.936 . . . . 0.0 110.785 179.961 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.596 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -89.73 37.64 0.88 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.123 -0.986 . . . . 0.0 110.806 -179.781 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.0 p -70.59 -11.28 60.84 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.011 -1.055 . . . . 0.0 109.971 178.894 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 1.4 tmm? -88.1 -18.55 28.6 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.236 -0.915 . . . . 0.0 110.445 179.64 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.489 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -57.24 139.01 53.98 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.89 -1.131 . . . . 0.0 110.036 -179.889 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -99.49 -177.57 3.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.387 -0.821 . . . . 0.0 109.493 -179.981 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -64.04 -37.5 87.66 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.253 -0.904 . . . . 0.0 110.032 -179.811 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -142.8 171.21 24.92 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.637 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.699 HD11 ' C ' ' A' ' 15' ' ' THR . 14.5 mt -54.44 121.87 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.381 -1.07 . . . . 0.0 109.861 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.51 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -68.35 146.83 52.9 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.39 -0.819 . . . . 0.0 108.822 179.182 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.38 157.59 41.5 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.297 -0.877 . . . . 0.0 109.763 179.278 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.426 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -152.44 -168.71 3.13 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 -179.904 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -61.8 105.5 0.56 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.885 -1.134 . . . . 0.0 108.279 179.012 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.494 ' HD3' ' OP1' ' C' ' 126' ' ' ' DC' . 2.8 ptp180 -45.25 135.37 5.86 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.286 -0.884 . . . . 0.0 110.048 -178.583 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.99 142.8 11.34 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.511 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.1 p -47.34 134.08 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.504 -0.747 . . . . 0.0 109.565 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.71 125.85 14.24 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.645 -0.659 . . . . 0.0 110.065 -179.329 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.499 1.988 0 O-C-N 121.366 -0.834 . . . . 0.0 110.236 179.842 . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.716 ' N7 ' HD22 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.525 1.782 0 O4'-C1'-N19 110.341 3.176 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.547 ' O6 ' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.066 1 O4'-C1'-N19 112.579 5.974 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.534 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.534 2.86 1 O4'-C1'-N19 111.202 4.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.555 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.15 1 O4'-C1'-N19 111.244 4.305 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.555 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.612 1.863 0 O4'-C1'-N19 110.834 3.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.937 0 O4'-C1'-N19 110.67 3.588 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.445 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.77 1 O4'-C1'-N19 111.225 4.282 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.445 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.91 0 O4'-C1'-N19 110.468 3.335 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.576 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 P--O5' 1.61 1.749 0 O4'-C1'-N19 110.777 3.722 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.576 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.402 1 O4'-C1'-N19 111.717 4.896 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.359 1 O4'-C1'-N19 111.042 4.052 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.5 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 P--O5' 1.612 1.918 0 O4'-C1'-N19 110.704 3.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.74 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.529 2.31 0 O4'-C1'-N19 110.539 3.424 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.535 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.532 2.563 1 O4'-C1'-N19 112.122 5.402 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.472 ' OP1' ' HD2' ' A' ' 56' ' ' ARG . . . . . . . . 0 C5'--C4' 1.532 2.627 0 O4'-C1'-N19 110.66 3.575 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.439 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.533 2.795 1 O4'-C1'-N19 111.007 4.009 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.1 mttt . . . . . 0 N--CA 1.494 1.744 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' ARG . . . . . 0.506 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 6.4 ttt180 -86.72 88.3 7.64 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.407 -0.808 . . . . 0.0 109.67 -179.793 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -68.81 133.24 48.04 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.394 -0.816 . . . . 0.0 109.359 179.809 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 109.03 -30.34 8.77 Favored Glycine 0 N--CA 1.498 2.825 0 N-CA-C 109.531 -1.427 . . . . 0.0 109.531 -179.348 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.726 HG23 ' HB2' ' A' ' 26' ' ' PRO . 16.2 m -78.62 90.24 4.55 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.128 -1.219 . . . . 0.0 109.579 179.654 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 6' ' ' VAL . 27.9 m -81.93 116.13 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 179.175 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.467 ' CB ' HG22 ' A' ' 12' ' ' THR . 41.3 t -49.1 113.87 0.89 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.203 -0.935 . . . . 0.0 110.11 -178.61 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -60.11 -15.29 22.23 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.635 -0.666 . . . . 0.0 111.141 -179.497 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.417 ' OD1' HG11 ' A' ' 27' ' ' VAL . 5.8 m-20 -96.69 -30.64 13.11 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.911 -1.118 . . . . 0.0 111.376 -179.051 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.542 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 15.6 p -140.49 26.16 2.16 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.698 -1.251 . . . . 0.0 111.189 179.939 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 40.56 27.88 0.04 OUTLIER 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.161 -0.962 . . . . 0.0 112.627 178.422 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.467 HG22 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -89.59 136.78 32.83 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.569 -1.332 . . . . 0.0 110.081 179.925 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.0 p -92.22 -30.42 15.92 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.493 -0.754 . . . . 0.0 109.033 179.168 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.5 p -92.45 125.32 37.05 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.364 -0.835 . . . . 0.0 109.601 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.598 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 16.4 p -143.3 148.94 37.12 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.165 -0.96 . . . . 0.0 110.814 179.961 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.74 HG21 " H3'" ' C' ' 124' ' ' ' DA' . 70.6 p -73.87 -33.92 64.25 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.956 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.716 HD22 ' N7 ' ' B' ' 106' ' ' ' DA' . 15.6 mt -150.87 105.45 3.27 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.405 -0.81 . . . . 0.0 108.92 179.536 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.598 ' CZ3' HG21 ' A' ' 15' ' ' THR . 7.0 m95 -63.49 84.22 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.421 -0.799 . . . . 0.0 110.936 -178.856 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.452 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.3 OUTLIER -80.43 77.51 7.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.08 -1.012 . . . . 0.0 109.194 179.36 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.559 ' CB ' ' HA ' ' A' ' 26' ' ' PRO . 5.2 ppt_? -80.0 138.62 37.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.022 -1.049 . . . . 0.0 110.033 -179.56 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -86.89 148.27 45.2 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.255 -0.903 . . . . 0.0 109.944 -179.802 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -55.0 -31.3 73.85 Favored 'Trans proline' 0 C--N 1.319 -1.026 0 C-N-CA 122.522 2.148 . . . . 0.0 111.024 -179.7 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.04 -28.56 53.12 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.409 -0.807 . . . . 0.0 109.803 179.195 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 117.09 34.52 1.22 Allowed Glycine 0 N--CA 1.497 2.713 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 179.678 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -130.88 96.03 24.02 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.281 -1.129 . . . . 0.0 109.911 -179.794 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.726 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.3 Cg_endo -65.17 106.21 0.79 Allowed 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 122.465 2.11 . . . . 0.0 110.31 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.457 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -119.1 129.27 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.071 -1.018 . . . . 0.0 110.428 -179.985 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.469 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 6.6 p -52.33 133.57 34.55 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 121.387 -0.82 . . . . 0.0 109.42 179.468 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 18.9 t-20 -34.34 -49.73 0.39 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.724 -0.61 . . . . 0.0 112.203 -178.445 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -46.82 -49.05 20.65 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.383 -0.823 . . . . 0.0 110.767 -179.424 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 27.1 m -62.56 -45.46 92.83 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.383 -0.823 . . . . 0.0 109.096 179.533 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.21 -30.59 64.4 Favored Glycine 0 N--CA 1.494 2.553 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 179.832 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 33' ' ' LEU . 60.6 mt -80.34 -63.12 1.48 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.391 -1.064 . . . . 0.0 109.8 -179.9 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -52.59 -35.17 53.67 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.32 -0.862 . . . . 0.0 109.174 179.635 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.6 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 8.5 t80 -66.37 -52.81 42.99 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.515 -0.74 . . . . 0.0 110.232 179.493 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -54.84 -28.42 49.68 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.135 -1.603 . . . . 0.0 109.985 -179.992 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mp -72.67 -64.37 0.97 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.083 -1.011 . . . . 0.0 110.662 -179.988 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.57 ' HB2' HG22 ' A' ' 40' ' ' VAL . 15.2 m80 -96.87 -28.01 14.42 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.141 -0.974 . . . . 0.0 110.653 -179.198 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.6 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.2 OUTLIER 76.08 26.53 0.98 Allowed 'General case' 0 N--CA 1.503 2.191 0 CA-C-O 121.599 0.714 . . . . 0.0 111.039 -179.929 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.57 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.0 m -113.91 166.93 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.035 -1.041 . . . . 0.0 109.848 178.63 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.8 p-10 -84.82 130.48 34.66 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.149 -0.969 . . . . 0.0 110.097 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -105.98 137.38 19.35 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.381 -0.825 . . . . 0.0 109.96 -179.554 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -63.57 145.53 91.85 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 122.237 1.958 . . . . 0.0 110.224 179.204 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.542 ' HB3' ' O ' ' A' ' 10' ' ' CYS . 1.7 pp -72.54 -4.23 29.35 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.206 -0.933 . . . . 0.0 110.943 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.64 -26.59 22.92 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.068 -1.02 . . . . 0.0 110.261 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -65.94 -26.37 67.56 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.899 -1.125 . . . . 0.0 109.685 179.17 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.02 165.68 24.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.182 -0.949 . . . . 0.0 109.687 179.475 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -127.96 -166.18 1.58 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.182 -0.949 . . . . 0.0 109.332 -179.938 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -46.83 -64.73 0.7 Allowed 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.315 -0.866 . . . . 0.0 109.958 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -117.74 -177.13 17.33 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.344 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.552 HG21 HG22 ' A' ' 16' ' ' THR . 5.3 mt -54.43 128.65 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.144 -1.21 . . . . 0.0 109.912 179.761 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.61 144.21 51.25 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.448 -0.782 . . . . 0.0 110.088 -179.933 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.16 160.92 41.28 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.373 -0.83 . . . . 0.0 109.549 178.959 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.67 -158.27 0.89 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.62 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -58.16 114.97 2.63 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.908 -1.12 . . . . 0.0 108.499 179.233 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.472 ' HD2' ' OP1' ' C' ' 126' ' ' ' DC' . 4.1 ttp180 -47.17 141.02 4.71 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.567 -0.708 . . . . 0.0 111.007 -178.622 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.48 127.94 32.04 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.585 -0.697 . . . . 0.0 109.74 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.65 158.23 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.644 -0.66 . . . . 0.0 109.476 179.935 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.8 p -64.1 135.34 56.29 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.065 -1.022 . . . . 0.0 109.312 179.909 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.6 t . . . . . 0 N--CA 1.495 1.81 0 O-C-N 121.281 -0.887 . . . . 0.0 109.006 -179.558 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.622 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.613 1.999 0 O4'-C1'-N19 110.817 3.771 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.622 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.029 1 O4'-C1'-N19 111.441 4.552 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.617 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.307 0 O4'-C1'-N19 110.957 3.946 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.617 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.005 0 O4'-C1'-N19 110.817 3.771 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.552 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.915 0 O4'-C1'-N19 110.67 3.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.421 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.909 0 O4'-C1'-N19 110.899 3.873 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.401 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.801 1 O4'-C1'-N19 111.65 4.813 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.787 0 O4'-C1'-N19 110.542 3.427 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.7 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.737 1 O4'-C1'-N19 111.457 4.571 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.7 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.533 2.715 1 O4'-C1'-N19 111.959 5.199 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.607 ' OP2' HD23 ' A' ' 37' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.342 1 O4'-C1'-N19 111.243 4.304 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.498 ' H71' ' HB3' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.141 0 O4'-C1'-N19 110.496 3.37 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.669 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.534 2.852 0 O4'-C1'-N19 110.654 3.568 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.744 ' O4 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.419 1 O4'-C1'-N19 112.266 5.583 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.495 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.535 2.971 0 O4'-C1'-N19 110.909 3.886 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.464 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.533 2.783 0 O4'-C1'-N19 110.9 3.875 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.816 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 . . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -26.3 31.58 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.325 -0.86 . . . . 0.0 109.344 179.964 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.37 107.6 2.47 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.072 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLY . . . . . 0.438 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 126.2 -12.49 7.16 Favored Glycine 0 N--CA 1.495 2.604 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 -179.333 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.512 HG23 ' CB ' ' A' ' 26' ' ' PRO . 17.4 m -54.4 100.58 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.025 -1.279 . . . . 0.0 108.942 179.188 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 4' ' ' GLY . 9.7 m -87.03 137.37 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 120.987 -1.071 . . . . 0.0 108.981 -179.454 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 31.9 t -67.02 117.57 9.26 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.335 -0.853 . . . . 0.0 110.583 -179.257 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.8 m -63.05 -7.61 5.8 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.381 -0.824 . . . . 0.0 110.545 178.913 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.429 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 2.4 m120 -109.82 -28.14 8.94 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.93 -1.106 . . . . 0.0 111.177 -179.389 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.53 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 14.6 p -142.5 17.22 2.03 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 120.501 -1.375 . . . . 0.0 111.59 -179.813 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 47.64 26.3 0.82 Allowed 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.21 -0.931 . . . . 0.0 112.116 178.576 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.458 ' H ' ' HB3' ' A' ' 7' ' ' CYS . 3.3 t -90.11 128.7 36.38 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.582 -1.324 . . . . 0.0 109.521 179.147 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.48 -27.99 19.97 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.849 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -88.8 106.59 18.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.483 -0.761 . . . . 0.0 109.562 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.613 HG21 ' CH2' ' A' ' 18' ' ' TRP . 17.8 p -128.34 157.05 42.05 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.449 -0.782 . . . . 0.0 110.212 -179.69 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.719 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 40.8 p -86.31 -39.68 16.25 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.946 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.744 HD11 ' O4 ' ' C' ' 125' ' ' ' DT' . 23.3 mt -138.04 102.27 4.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.435 -0.79 . . . . 0.0 109.417 179.638 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.613 ' CH2' HG21 ' A' ' 15' ' ' THR . 5.7 m95 -62.9 106.76 0.86 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.39 -0.819 . . . . 0.0 110.148 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -97.42 73.87 2.44 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.445 -0.785 . . . . 0.0 109.384 179.828 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.494 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -67.04 112.37 4.35 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.224 -0.922 . . . . 0.0 109.124 179.898 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.04 150.99 97.41 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.178 -0.951 . . . . 0.0 109.434 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -52.81 -41.06 72.69 Favored 'Trans proline' 0 C--N 1.317 -1.091 0 C-N-CA 122.486 2.124 . . . . 0.0 111.186 -179.147 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -25.29 50.22 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.264 -0.897 . . . . 0.0 110.06 179.331 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.5 44.43 0.84 Allowed Glycine 0 N--CA 1.497 2.746 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 179.767 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -128.08 98.74 26.3 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.326 -1.103 . . . . 0.0 110.46 -179.652 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.0 Cg_endo -66.5 94.91 0.32 Allowed 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.372 2.048 . . . . 0.0 109.998 178.811 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.534 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -114.08 123.71 70.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 120.961 -1.087 . . . . 0.0 110.406 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.6 p -48.42 132.8 16.67 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.64 -0.663 . . . . 0.0 109.379 179.338 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.605 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t-20 -40.44 -40.98 1.31 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.658 -0.652 . . . . 0.0 111.568 -177.943 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.58 -43.98 56.7 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.96 -1.088 . . . . 0.0 110.478 179.773 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.429 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 13.3 m -65.73 -39.2 90.89 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.314 -0.866 . . . . 0.0 109.265 179.445 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.14 -53.98 12.69 Favored Glycine 0 N--CA 1.496 2.697 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.634 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.498 ' HB3' ' H71' ' C' ' 123' ' ' ' DT' . 48.0 mt -57.32 -57.2 13.66 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.341 -1.094 . . . . 0.0 109.941 -179.462 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.554 ' OH ' ' HD2' ' A' ' 42' ' ' ARG . 78.5 t80 -50.67 -43.97 57.61 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.583 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.617 ' O ' ' N ' ' A' ' 39' ' ' GLN . 27.4 t80 -57.57 -54.79 42.82 Favored 'General case' 0 C--O 1.195 -1.811 0 O-C-N 121.502 -0.749 . . . . 0.0 109.402 179.456 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -49.42 -34.35 16.24 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 119.932 -1.73 . . . . 0.0 111.096 179.781 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.607 HD23 ' OP2' ' C' ' 122' ' ' ' DT' . 9.6 mp -57.94 -65.12 0.69 Allowed 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.082 -1.011 . . . . 0.0 110.408 -179.638 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 -99.11 -33.15 10.9 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.256 -0.903 . . . . 0.0 109.03 179.549 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.617 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 73.2 47.99 0.18 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.868 0.842 . . . . 0.0 110.099 179.088 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 m -140.57 166.26 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 178.544 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -77.61 145.52 36.73 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.854 -1.154 . . . . 0.0 109.396 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.554 ' HD2' ' OH ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -146.22 150.23 40.77 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 120.918 -1.114 . . . . 0.0 110.125 -179.686 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.441 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 5.9 Cg_exo -57.18 147.43 76.09 Favored 'Trans proline' 0 C--N 1.314 -1.243 0 C-N-CA 122.227 1.952 . . . . 0.0 110.796 -179.947 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.547 ' H ' HD23 ' A' ' 44' ' ' LEU . 0.4 OUTLIER -86.59 23.93 1.54 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.498 -0.751 . . . . 0.0 110.591 179.993 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 70.5 p -68.67 -12.69 61.69 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.999 -1.063 . . . . 0.0 110.336 179.374 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -86.11 -31.27 21.97 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.252 -0.905 . . . . 0.0 110.303 -179.83 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.488 ' HG2' ' N ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -80.62 158.49 25.67 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.11 -0.994 . . . . 0.0 109.775 -179.814 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.488 ' N ' ' HG2' ' A' ' 47' ' ' ARG . 10.3 tttp -131.78 173.56 11.04 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.054 -1.029 . . . . 0.0 109.93 179.78 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.48 -37.72 77.38 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.354 -0.841 . . . . 0.0 109.586 179.854 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -97.63 132.32 10.93 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 179.158 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.566 HG21 HG22 ' A' ' 16' ' ' THR . 4.8 mt -53.47 104.04 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.387 -1.066 . . . . 0.0 109.912 -179.626 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 52' ' ' GLN . . . . . 0.475 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 1.9 mt-30 -46.5 96.76 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.009 0 O-C-N 122.047 -0.408 . . . . 0.0 111.041 -179.363 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 51' ' ' ILE . 0.3 OUTLIER -121.86 153.04 38.91 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.949 -1.094 . . . . 0.0 110.859 179.583 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.55 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 1.6 ptm180 -154.17 -154.45 0.52 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 115.541 -0.754 . . . . 0.0 108.971 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 55' ' ' ASN . . . . . 0.48 ' N ' ' HG3' ' A' ' 54' ' ' ARG . 23.7 t-20 -58.54 121.09 10.1 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 177.988 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' ARG . . . . . 0.455 ' CB ' " H4'" ' C' ' 125' ' ' ' DT' . 0.0 OUTLIER -86.14 -169.43 2.64 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.419 -0.8 . . . . 0.0 111.083 -178.449 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -84.19 157.04 21.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.305 -0.872 . . . . 0.0 109.645 179.904 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 59' ' ' SER . 14.6 p -79.99 166.43 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.837 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 59' ' ' SER . . . . . 0.48 ' N ' HG22 ' A' ' 58' ' ' VAL . 12.4 p -54.44 113.48 1.29 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.905 -1.122 . . . . 0.0 109.124 179.588 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.495 1.823 0 O-C-N 121.451 -0.781 . . . . 0.0 110.731 -178.91 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.545 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.957 0 O4'-C1'-N19 110.708 3.635 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.562 ' N7 ' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.526 1.814 1 O4'-C1'-N19 111.874 5.092 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.553 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.076 1 O4'-C1'-N19 111.043 4.054 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.553 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.105 1 O4'-C1'-N19 111.05 4.063 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.546 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.868 0 O4'-C1'-N19 110.524 3.405 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.41 " H2'" ' C8 ' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.158 0 O4'-C1'-N19 110.68 3.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.442 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.04 1 O4'-C1'-N19 111.202 4.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.442 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.612 1.901 0 C3'-C2'-C1' 107.177 3.198 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.654 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.813 1 O4'-C1'-N19 111.113 4.141 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.654 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.533 2.781 1 O4'-C1'-N19 111.877 5.097 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.438 ' H71' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.468 1 O4'-C1'-N19 111.01 4.012 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.584 ' H73' ' HB3' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.529 2.237 0 O4'-C1'-N19 110.633 3.541 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.466 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.728 0 O4'-C1'-N19 110.62 3.525 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.627 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.71 1 O4'-C1'-N19 112.435 5.794 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.492 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.098 0 O4'-C1'-N19 110.578 3.473 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.455 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.174 0 O4'-C1'-N19 110.749 3.686 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.5 mttt . . . . . 0 N--CA 1.498 1.948 0 CA-C-O 120.919 0.39 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -81.6 74.65 8.58 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.15 -0.969 . . . . 0.0 110.008 -179.576 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.23 113.79 3.08 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.473 -0.767 . . . . 0.0 109.294 179.608 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.9 -30.26 4.89 Favored Glycine 0 N--CA 1.496 2.682 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 -179.202 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' THR . . . . . 0.623 HG23 ' HB2' ' A' ' 26' ' ' PRO . 4.9 m -72.18 88.93 1.15 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.266 -1.138 . . . . 0.0 109.472 179.505 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 6' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 6' ' ' VAL . 15.9 m -78.73 120.19 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.124 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.562 ' HB2' HG22 ' A' ' 12' ' ' THR . 45.3 t -49.42 112.78 0.69 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.191 -0.943 . . . . 0.0 110.585 -178.411 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 71.0 m -57.19 -16.97 9.29 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.412 -0.805 . . . . 0.0 110.839 179.858 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' ASN . . . . . 0.472 ' CB ' ' SG ' ' A' ' 31' ' ' CYS . 25.3 m-20 -98.87 -31.01 12.07 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.002 -1.061 . . . . 0.0 111.437 -179.206 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 19.1 p -138.73 22.02 2.68 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.468 -1.395 . . . . 0.0 111.474 179.294 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.481 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER 44.59 21.02 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.303 -0.873 . . . . 0.0 112.692 178.851 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.562 HG22 ' HB2' ' A' ' 7' ' ' CYS . 6.1 t -80.78 130.48 35.09 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.579 -1.325 . . . . 0.0 109.749 179.927 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.0 p -90.47 -4.93 56.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.29 -0.881 . . . . 0.0 109.42 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.418 ' HB ' HG13 ' A' ' 51' ' ' ILE . 31.9 p -118.65 121.45 40.18 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -0.947 . . . . 0.0 110.085 -179.616 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.603 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 21.5 p -143.58 160.88 39.85 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.323 -0.861 . . . . 0.0 110.117 179.475 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.627 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 21.3 p -81.52 -47.45 13.1 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.877 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.562 ' CD1' ' N7 ' ' B' ' 107' ' ' ' DG' . 10.9 mt -130.94 109.92 10.89 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.686 -0.633 . . . . 0.0 109.37 179.206 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.603 ' CZ2' HG23 ' A' ' 15' ' ' THR . 16.7 m95 -79.34 85.83 5.13 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.577 -0.702 . . . . 0.0 109.79 -179.615 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 19' ' ' ARG . . . . . 0.598 ' HD3' ' HA ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -77.57 93.64 4.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.073 -1.017 . . . . 0.0 109.335 179.556 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.477 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -68.06 124.21 22.77 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.33 -0.856 . . . . 0.0 110.149 -179.27 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -81.26 141.17 49.46 Favored Pre-proline 0 N--CA 1.499 1.989 0 O-C-N 121.361 -0.837 . . . . 0.0 109.559 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -54.36 -41.17 78.91 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 122.515 2.144 . . . . 0.0 110.933 -179.766 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.3 mtp -59.78 -20.44 56.74 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.32 -0.863 . . . . 0.0 109.95 179.386 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.54 39.66 1.44 Allowed Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 179.827 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -127.6 91.19 46.3 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.379 -1.071 . . . . 0.0 110.146 -179.818 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.623 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.6 Cg_endo -64.36 100.3 0.32 Allowed 'Trans proline' 0 C--N 1.311 -1.424 0 C-N-CA 122.203 1.935 . . . . 0.0 109.524 179.064 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.463 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.0 m -109.12 153.88 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 120.869 -1.144 . . . . 0.0 110.998 -179.476 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.507 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 16.0 p -81.8 138.88 35.06 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.598 ' HA ' ' HD3' ' A' ' 19' ' ' ARG . 6.0 t-20 -38.12 -36.64 0.22 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.781 -0.575 . . . . 0.0 111.812 -178.64 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.69 -43.07 81.01 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.271 -0.893 . . . . 0.0 111.76 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.472 ' SG ' ' CB ' ' A' ' 9' ' ' ASN . 1.8 m -57.98 -41.01 82.07 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.001 -1.062 . . . . 0.0 109.621 -179.671 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' GLY . . . . . 0.455 ' HA3' ' CZ ' ' A' ' 19' ' ' ARG . . . -74.02 -39.59 45.46 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 -179.925 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.584 ' HB3' ' H73' ' C' ' 123' ' ' ' DT' . 25.0 mt -64.65 -65.15 0.71 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.484 -1.01 . . . . 0.0 110.26 -179.616 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.792 ' HA ' HD22 ' A' ' 37' ' ' LEU . 23.3 t80 -51.74 -39.98 59.44 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.233 -0.917 . . . . 0.0 108.843 179.77 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.485 ' O ' ' N ' ' A' ' 39' ' ' GLN . 60.2 t80 -53.59 -47.81 69.81 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.564 -0.71 . . . . 0.0 109.633 179.198 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -66.99 -38.67 86.44 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.208 -0.933 . . . . 0.0 110.14 -179.902 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.792 HD22 ' HA ' ' A' ' 34' ' ' TYR . 0.4 OUTLIER -45.27 -53.21 8.67 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.293 -0.879 . . . . 0.0 110.031 -179.564 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.543 ' CB ' HG22 ' A' ' 40' ' ' VAL . 50.8 m80 -111.53 6.37 20.07 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.351 -0.843 . . . . 0.0 109.549 179.156 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 35' ' ' TYR . 3.2 tp-100 49.22 32.67 4.42 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.431 -0.793 . . . . 0.0 110.133 -178.751 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.543 HG22 ' CB ' ' A' ' 38' ' ' HIS . 4.0 m -134.08 -174.44 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.503 -0.748 . . . . 0.0 109.558 179.826 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -61.97 172.5 1.35 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.237 -0.915 . . . . 0.0 110.319 179.574 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.597 ' HB3' ' CD1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -133.36 131.38 21.51 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.24 -0.912 . . . . 0.0 109.451 -179.867 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.24 112.93 1.85 Allowed 'Trans proline' 0 C--N 1.315 -1.218 0 C-N-CA 122.135 1.89 . . . . 0.0 110.335 179.857 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -72.74 -7.24 49.61 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.21 -0.931 . . . . 0.0 110.378 179.779 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 75.0 p -54.42 -20.66 7.9 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.05 -1.031 . . . . 0.0 110.003 178.631 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.03 -15.36 62.55 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.139 -0.975 . . . . 0.0 110.725 179.627 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 12.0 mmm180 -56.56 148.03 20.69 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 120.719 -1.238 . . . . 0.0 110.24 -179.785 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.85 -162.92 1.27 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.42 -0.8 . . . . 0.0 109.852 -179.916 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -79.99 -41.17 26.4 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.12 -0.988 . . . . 0.0 109.884 179.982 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -133.15 165.89 23.88 Favored Glycine 0 N--CA 1.498 2.793 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.418 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.4 mt -56.59 125.87 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.195 -1.18 . . . . 0.0 109.973 179.87 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.63 154.53 32.58 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.561 -0.712 . . . . 0.0 109.589 179.247 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.84 165.32 36.83 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.977 -1.077 . . . . 0.0 109.252 179.1 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.435 HH11 ' CG ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -150.46 -172.68 4.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.539 -0.725 . . . . 0.0 109.382 -179.421 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -51.69 118.69 3.55 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.106 -0.996 . . . . 0.0 108.718 179.228 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -47.43 140.58 5.62 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.581 -0.7 . . . . 0.0 110.351 -178.985 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.2 ttmt -54.25 134.95 44.94 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.581 -0.699 . . . . 0.0 110.149 -179.742 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.38 137.27 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.495 -0.753 . . . . 0.0 109.415 179.69 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.77 115.04 15.05 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.256 -0.903 . . . . 0.0 109.778 -179.566 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.494 1.736 0 O-C-N 121.23 -0.919 . . . . 0.0 110.306 -179.873 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 106' ' ' ' DA' . . . . . 0.505 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.928 0 O4'-C1'-N19 110.702 3.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 107' ' ' ' DG' . . . . . 0.505 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.932 1 O4'-C1'-N19 111.469 4.586 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 108' ' ' ' DA' . . . . . 0.531 ' N6 ' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.349 1 O4'-C1'-N19 111.043 4.054 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 109' ' ' ' DT' . . . . . 0.533 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 P--O5' 1.615 2.211 0 O4'-C1'-N19 110.901 3.877 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 110' ' ' ' DA' . . . . . 0.533 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.208 0 O4'-C1'-N19 110.778 3.723 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 111' ' ' ' DA' . . . . . 0.401 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.97 0 O4'-C1'-N19 110.855 3.818 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 112' ' ' ' DA' . . . . . 0.401 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.955 1 O4'-C1'-N19 111.711 4.889 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 113' ' ' ' DC' . . . . . 0.4 " H5'" ' NE ' ' A' ' 54' ' ' ARG . . . . . . . . 0 P--O5' 1.612 1.926 0 O4'-C1'-N19 110.558 3.447 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 120' ' ' ' DG' . . . . . 0.664 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.921 1 O4'-C1'-N19 111.152 4.19 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 121' ' ' ' DT' . . . . . 0.686 " H2'" ' H72' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.775 1 O4'-C1'-N19 111.864 5.08 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 122' ' ' ' DT' . . . . . 0.686 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.713 1 O4'-C1'-N19 111.434 4.543 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 123' ' ' ' DT' . . . . . 0.488 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.112 0 O4'-C1'-N19 110.912 3.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 124' ' ' ' DA' . . . . . 0.537 " H2'" ' H71' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.466 0 O4'-C1'-N19 110.816 3.769 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 125' ' ' ' DT' . . . . . 0.686 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.528 2.127 1 O4'-C1'-N19 111.965 5.206 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear build full ' C' C ' 126' ' ' ' DC' . . . . . 0.608 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.695 0 O4'-C1'-N19 110.407 3.258 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' C' C ' 127' ' ' ' DT' . . . . . 0.46 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.306 0 O4'-C1'-N19 110.646 3.557 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.854 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -83.65 2.33 38.06 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.312 -0.868 . . . . 0.0 110.4 179.718 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.4 119.52 7.12 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.251 -0.906 . . . . 0.0 109.039 179.209 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.3 -23.83 5.41 Favored Glycine 0 N--CA 1.496 2.649 0 N-CA-C 109.266 -1.534 . . . . 0.0 109.266 -178.947 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.0 m -69.13 93.36 0.59 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.31 -1.112 . . . . 0.0 109.843 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.68 129.74 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 178.41 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' CYS . . . . . 0.508 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 6.9 t -45.13 111.98 0.39 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.523 -0.736 . . . . 0.0 111.132 -178.638 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -60.58 -13.32 13.53 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.25 -0.906 . . . . 0.0 110.671 179.679 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -105.03 -28.59 10.96 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.776 -1.203 . . . . 0.0 111.589 -179.309 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' CYS . . . . . 0.623 ' SG ' ' HD2' ' A' ' 47' ' ' ARG . 9.4 p -138.71 24.7 2.62 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.637 -1.289 . . . . 0.0 110.59 179.005 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 11' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 1.3 pt20 38.45 25.98 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 179.132 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' THR . . . . . 0.466 HG22 ' HB2' ' A' ' 7' ' ' CYS . 3.8 t -90.1 124.18 34.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.589 -1.319 . . . . 0.0 109.816 179.228 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.07 -23.96 21.28 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.447 -0.783 . . . . 0.0 109.711 -179.867 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 14' ' ' THR . . . . . 0.513 ' HB ' HG13 ' A' ' 51' ' ' ILE . 2.9 p -89.86 94.13 9.7 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.225 -0.922 . . . . 0.0 109.173 179.807 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 15' ' ' THR . . . . . 0.544 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 5.2 p -117.71 149.59 40.5 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.269 -0.895 . . . . 0.0 110.059 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' THR . . . . . 0.686 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 30.7 p -74.04 -33.72 63.83 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 179.145 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 17' ' ' LEU . . . . . 0.531 ' CD1' ' N6 ' ' B' ' 108' ' ' ' DA' . 73.3 mt -146.32 108.52 4.42 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.34 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 18' ' ' TRP . . . . . 0.544 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.6 m95 -65.39 86.33 0.07 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.382 -0.824 . . . . 0.0 109.696 -179.774 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -76.98 80.25 3.52 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.433 -0.792 . . . . 0.0 109.381 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ARG . . . . . 0.486 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -57.91 123.45 15.84 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.364 -0.835 . . . . 0.0 109.594 -179.832 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 t -78.58 145.99 68.53 Favored Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.346 -0.846 . . . . 0.0 109.912 -179.599 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -58.76 -23.17 65.28 Favored 'Trans proline' 0 C--N 1.319 -1.024 0 C-N-CA 122.443 2.095 . . . . 0.0 110.482 179.185 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.04 1.28 21.47 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.207 -0.933 . . . . 0.0 110.307 179.309 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.85 29.89 16.72 Favored Glycine 0 N--CA 1.497 2.741 0 N-CA-C 109.412 -1.475 . . . . 0.0 109.412 -179.562 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -121.34 101.03 44.4 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.406 -1.055 . . . . 0.0 110.339 -179.419 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 3.2 Cg_exo -63.11 99.69 0.23 Allowed 'Trans proline' 0 C--N 1.311 -1.417 0 C-N-CA 121.997 1.798 . . . . 0.0 109.605 178.48 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.508 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 1.6 m -110.34 154.56 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 CA-C-O 122.292 1.044 . . . . 0.0 111.024 -179.77 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.405 ' O ' ' C ' ' A' ' 29' ' ' ASN . 15.7 p -81.14 138.37 35.9 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.689 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 29' ' ' ASN . . . . . 0.423 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 3.5 t-20 -35.22 -46.8 0.37 Allowed 'General case' 0 N--CA 1.504 2.275 0 O-C-N 121.657 -0.652 . . . . 0.0 112.093 -178.551 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' ALA . . . . . 0.437 ' HB3' HH12 ' A' ' 47' ' ' ARG . . . -55.15 -47.26 75.37 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.377 -0.827 . . . . 0.0 111.472 -179.339 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 31' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 3.4 m -57.19 -38.66 73.98 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.091 -1.006 . . . . 0.0 109.81 179.966 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -72.92 -36.52 57.36 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.991 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 37' ' ' LEU . 81.0 mt -73.15 -66.22 0.71 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.432 -1.04 . . . . 0.0 110.09 -179.851 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' TYR . . . . . 0.464 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 80.2 t80 -46.34 -34.46 4.58 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.357 -0.839 . . . . 0.0 109.173 179.655 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 35' ' ' TYR . . . . . 0.632 ' O ' ' N ' ' A' ' 39' ' ' GLN . 30.5 t80 -63.47 -62.58 1.58 Allowed 'General case' 0 C--O 1.193 -1.886 0 O-C-N 121.285 -0.885 . . . . 0.0 109.009 178.746 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 tttm -48.06 -30.41 4.41 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 120.084 -1.635 . . . . 0.0 110.799 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.606 HD23 ' P ' ' C' ' 122' ' ' ' DT' . 9.6 mp -57.33 -69.52 0.16 Allowed 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.198 -0.939 . . . . 0.0 109.971 179.734 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' HIS . . . . . 0.543 ' HB2' HG22 ' A' ' 40' ' ' VAL . 17.6 m-70 -99.38 -28.74 13.14 Favored 'General case' 0 N--CA 1.506 2.34 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.039 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.632 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.9 OUTLIER 76.19 49.0 0.07 Allowed 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 122.059 0.933 . . . . 0.0 110.346 179.21 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 40' ' ' VAL . . . . . 0.543 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.8 m -133.44 -178.87 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.558 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -59.1 161.05 5.53 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.641 -1.287 . . . . 0.0 110.022 179.779 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' ARG . . . . . 0.499 ' CD ' ' N ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -127.21 106.69 21.69 Favored Pre-proline 0 N--CA 1.498 1.962 0 O-C-N 121.041 -1.037 . . . . 0.0 109.759 -179.12 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.16 141.93 90.08 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 122.353 2.035 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' LEU . . . . . 0.643 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -84.8 5.52 28.3 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.257 -0.902 . . . . 0.0 110.785 179.953 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 54.6 p -61.24 -26.7 67.93 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.461 -1.399 . . . . 0.0 109.696 179.054 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.65 4.19 33.57 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.133 -0.979 . . . . 0.0 110.821 179.79 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 47' ' ' ARG . . . . . 0.623 ' HD2' ' SG ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -82.35 -174.9 5.41 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.567 -1.333 . . . . 0.0 109.621 179.636 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -151.43 156.9 41.59 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.124 -0.985 . . . . 0.0 109.416 179.793 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -55.03 -35.2 64.19 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.295 -0.878 . . . . 0.0 109.792 179.878 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.88 146.92 16.63 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 109.071 -1.612 . . . . 0.0 109.071 179.033 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' ILE . . . . . 0.513 HG13 ' HB ' ' A' ' 14' ' ' THR . 6.0 mt -50.22 120.62 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.345 -1.091 . . . . 0.0 109.852 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.79 151.57 33.81 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.404 -0.81 . . . . 0.0 109.563 179.814 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' THR . . . . . 0.431 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -155.49 165.04 37.82 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.266 -0.896 . . . . 0.0 109.419 179.445 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 54' ' ' ARG . . . . . 0.482 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 2.1 mtm-85 -145.64 -152.49 0.43 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.625 -0.672 . . . . 0.0 109.709 -179.5 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.58 122.56 16.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.112 -0.993 . . . . 0.0 109.105 179.324 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.06 112.82 0.48 Allowed 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.446 0.641 . . . . 0.0 110.752 -179.171 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.19 112.21 7.15 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.389 -0.819 . . . . 0.0 109.287 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.9 p -80.09 149.1 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.192 -0.942 . . . . 0.0 108.917 179.604 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.68 139.45 57.22 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.083 -1.011 . . . . 0.0 109.732 -179.576 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.494 1.733 0 O-C-N 121.35 -0.844 . . . . 0.0 110.492 -179.739 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.498 1.946 0 CA-C-O 121.263 0.554 . . . . 0.0 109.619 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.32 -31.77 7.8 Favored Glycine 0 N--CA 1.494 2.549 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.603 HG23 ' HB2' ' A' ' 26' ' ' PRO . 3.5 m -63.5 91.69 0.06 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.343 -1.092 . . . . 0.0 109.137 178.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 m -88.93 122.17 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.516 ' CB ' HG22 ' A' ' 12' ' ' THR . 49.5 t -49.57 118.06 2.57 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.336 -0.853 . . . . 0.0 110.602 -178.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.1 m -65.33 -7.71 14.81 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.411 -0.806 . . . . 0.0 111.115 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.63 ' OD1' HG11 ' A' ' 27' ' ' VAL . 6.8 m120 -107.78 -23.64 12.0 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 120.732 -1.23 . . . . 0.0 110.858 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.534 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 14.0 p -145.41 20.63 1.53 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.669 -1.269 . . . . 0.0 111.176 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER 45.05 20.31 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.451 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 178.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.516 HG22 ' CB ' ' A' ' 7' ' ' CYS . 14.1 t -77.4 135.78 38.35 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.34 -1.475 . . . . 0.0 109.655 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.3 p -95.0 -21.37 18.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.536 -0.728 . . . . 0.0 109.347 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.505 ' HB ' HG13 ' A' ' 51' ' ' ILE . 72.3 p -109.45 120.31 42.1 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.249 -0.907 . . . . 0.0 109.772 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.584 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 4.4 p -135.71 159.77 40.62 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.279 -0.888 . . . . 0.0 109.591 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.437 HG22 HG21 ' A' ' 51' ' ' ILE . 6.0 p -83.54 -30.77 26.81 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.562 -0.711 . . . . 0.0 109.205 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.61 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 45.9 mt -142.13 91.3 2.33 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.345 -0.847 . . . . 0.0 109.371 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.568 ' CZ2' HG23 ' A' ' 15' ' ' THR . 18.5 m95 -64.2 109.1 1.75 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.296 -0.877 . . . . 0.0 109.806 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.566 ' HG3' ' O ' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -98.85 130.32 45.26 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.224 -0.922 . . . . 0.0 109.403 179.651 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.8 mmm180 -96.38 119.8 35.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.16 -0.963 . . . . 0.0 109.745 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.6 t -79.21 142.8 59.56 Favored Pre-proline 0 N--CA 1.499 2.018 0 O-C-N 121.206 -0.934 . . . . 0.0 109.478 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -54.32 -41.61 74.87 Favored 'Trans proline' 0 C--N 1.32 -0.959 0 C-N-CA 122.655 2.237 . . . . 0.0 111.0 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.7 mtm -62.05 -21.06 64.61 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.268 -0.895 . . . . 0.0 109.412 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.02 44.66 1.08 Allowed Glycine 0 N--CA 1.497 2.753 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -129.28 98.94 22.14 Favored Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.155 -1.203 . . . . 0.0 110.822 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.603 ' HB2' HG23 ' A' ' 5' ' ' THR . 1.8 Cg_endo -65.97 107.09 1.06 Allowed 'Trans proline' 0 C--N 1.314 -1.247 0 C-N-CA 122.101 1.867 . . . . 0.0 109.241 178.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.63 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.0 m -122.88 126.28 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 O-C-N 121.135 -0.978 . . . . 0.0 110.506 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.584 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.2 p -48.06 131.12 15.87 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.404 -0.81 . . . . 0.0 109.839 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.61 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 5.6 t-20 -35.09 -43.68 0.21 Allowed 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.837 -0.54 . . . . 0.0 112.156 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.43 -45.42 62.63 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.276 -0.89 . . . . 0.0 110.606 -179.664 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.475 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 18.6 m -64.75 -37.44 87.59 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.331 -0.856 . . . . 0.0 108.999 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.29 -53.53 25.05 Favored Glycine 0 N--CA 1.495 2.602 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.529 ' O ' HD13 ' A' ' 37' ' ' LEU . 93.7 mt -55.74 -58.44 7.81 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.503 -0.998 . . . . 0.0 109.877 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.691 ' HA ' HD22 ' A' ' 37' ' ' LEU . 11.4 t80 -47.28 -42.62 21.24 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.489 -0.757 . . . . 0.0 109.749 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.417 ' O ' ' N ' ' A' ' 39' ' ' GLN . 40.4 t80 -52.29 -46.99 66.13 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.374 -0.829 . . . . 0.0 109.979 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.4 -38.1 77.8 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 120.82 -1.175 . . . . 0.0 110.206 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.691 HD22 ' HA ' ' A' ' 34' ' ' TYR . 6.0 mp -42.97 -52.46 5.19 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.565 -0.709 . . . . 0.0 110.16 -179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.465 ' CB ' HG22 ' A' ' 40' ' ' VAL . 78.6 m-70 -121.37 12.13 10.84 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.18 -0.95 . . . . 0.0 110.082 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.417 ' N ' ' O ' ' A' ' 35' ' ' TYR . 8.4 tt0 50.13 34.92 9.13 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.356 -0.84 . . . . 0.0 110.141 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.465 HG22 ' CB ' ' A' ' 38' ' ' HIS . 2.9 m -135.96 -165.42 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 O-C-N 121.313 -0.867 . . . . 0.0 109.203 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.7 p30 -62.93 -173.82 0.06 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.224 -0.922 . . . . 0.0 110.254 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.475 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -146.41 106.97 4.11 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.283 -0.885 . . . . 0.0 109.884 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.511 ' HD2' ' CZ ' ' A' ' 34' ' ' TYR . 3.5 Cg_exo -60.34 128.01 24.8 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 C-N-CA 122.234 1.956 . . . . 0.0 110.08 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.672 HD23 ' H ' ' A' ' 44' ' ' LEU . 0.9 OUTLIER -93.3 25.48 3.34 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.335 -0.853 . . . . 0.0 110.884 -179.299 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -6.91 29.67 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.031 -1.043 . . . . 0.0 110.849 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 57.8 mtm -102.93 -7.82 21.19 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.871 -1.143 . . . . 0.0 110.61 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.518 ' HG3' ' NH1' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -81.64 164.76 21.61 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.869 -1.144 . . . . 0.0 110.451 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.2 -169.12 3.23 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.365 -0.835 . . . . 0.0 109.719 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -78.84 -9.53 59.5 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.093 -1.004 . . . . 0.0 110.699 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -137.17 145.08 16.8 Favored Glycine 0 N--CA 1.499 2.882 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.505 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.1 mt -54.18 124.3 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.405 -1.056 . . . . 0.0 110.108 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.49 159.59 33.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.451 -0.781 . . . . 0.0 109.4 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.32 163.34 40.25 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.011 -1.055 . . . . 0.0 109.378 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -149.86 -163.26 1.74 Allowed 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.4 93.93 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.042 -1.036 . . . . 0.0 108.515 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.36 150.19 1.36 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.566 -0.709 . . . . 0.0 109.972 -179.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt . . . . . 0 N--CA 1.495 1.808 0 O-C-N 121.358 -0.839 . . . . 0.0 109.641 179.921 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.765 0 N-CA-C 109.054 -0.721 . . . . 0.0 109.054 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.44 -30.44 3.45 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.369 -1.493 . . . . 0.0 109.369 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.471 HG22 ' CH2' ' A' ' 18' ' ' TRP . 72.8 m -72.09 86.15 1.04 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.088 -1.242 . . . . 0.0 109.316 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 6' ' ' VAL . 28.3 m -88.46 112.81 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.528 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 52.9 t -47.99 108.05 0.15 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.466 -0.771 . . . . 0.0 110.732 -178.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.9 m -59.76 -14.96 16.84 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.309 -0.869 . . . . 0.0 111.129 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.539 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.9 OUTLIER -90.36 -30.11 17.63 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.032 -1.043 . . . . 0.0 110.739 -179.788 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.788 ' HA ' HD22 ' A' ' 44' ' ' LEU . 16.3 p -143.25 23.81 1.82 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.627 -1.296 . . . . 0.0 110.908 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.469 ' N ' ' O ' ' A' ' 7' ' ' CYS . 7.1 mt-30 44.61 22.56 0.06 Allowed 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.354 -0.842 . . . . 0.0 112.201 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.604 HG22 ' SG ' ' A' ' 10' ' ' CYS . 6.7 t -89.19 125.63 35.15 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.515 -1.366 . . . . 0.0 110.051 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.6 t -90.96 -17.11 26.91 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.638 -0.664 . . . . 0.0 109.639 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.529 ' HB ' HG13 ' A' ' 51' ' ' ILE . 23.0 p -101.42 115.63 30.93 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.252 -0.905 . . . . 0.0 109.035 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.529 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 6.9 p -135.44 153.17 51.86 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.218 -0.926 . . . . 0.0 110.211 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.636 HG22 HG21 ' A' ' 51' ' ' ILE . 40.7 p -83.43 -34.74 25.4 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.575 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 35.4 mt -137.61 96.96 3.34 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.475 -0.766 . . . . 0.0 109.312 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CZ3' HG21 ' A' ' 15' ' ' THR . 8.6 m95 -62.93 110.96 1.95 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.153 -0.967 . . . . 0.0 109.843 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.34 104.51 14.13 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.358 -0.839 . . . . 0.0 109.237 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.456 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -73.21 115.14 12.19 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.098 . . . . 0.0 108.812 179.784 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.537 ' HB3' ' HG2' ' A' ' 23' ' ' MET . 0.2 OUTLIER -67.95 144.49 97.2 Favored Pre-proline 0 N--CA 1.5 2.064 0 O-C-N 121.21 -0.931 . . . . 0.0 110.293 -179.118 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -55.18 -40.84 83.68 Favored 'Trans proline' 0 C--N 1.319 -1.013 0 C-N-CA 122.867 2.378 . . . . 0.0 110.952 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.537 ' HG2' ' HB3' ' A' ' 21' ' ' SER . 1.4 ptt? -54.73 -23.8 19.34 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.401 -0.812 . . . . 0.0 109.986 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.57 37.18 1.47 Allowed Glycine 0 N--CA 1.497 2.713 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -136.23 116.19 11.13 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 120.864 -1.374 . . . . 0.0 110.322 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 5.1 Cg_exo -62.06 106.13 0.44 Allowed 'Trans proline' 0 C--N 1.316 -1.177 0 C-N-CA 122.321 2.014 . . . . 0.0 110.026 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.528 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.8 m -120.37 126.01 74.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.104 -0.997 . . . . 0.0 110.665 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.408 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 9.7 p -49.27 133.67 19.13 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 121.443 0.64 . . . . 0.0 109.456 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.575 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 8.1 t-20 -37.9 -45.43 0.86 Allowed 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.578 -0.701 . . . . 0.0 111.577 -178.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.71 -46.49 40.77 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.208 -0.933 . . . . 0.0 110.96 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.539 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 6.9 m -60.24 -47.05 87.62 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.44 -32.44 64.38 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 109.626 -1.389 . . . . 0.0 109.626 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.537 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 81.9 mt -75.85 -64.01 1.18 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.512 -0.993 . . . . 0.0 109.284 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.487 ' HA ' HD22 ' A' ' 37' ' ' LEU . 9.3 t80 -47.13 -38.71 12.02 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.055 -1.028 . . . . 0.0 109.143 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.438 ' O ' ' N ' ' A' ' 39' ' ' GLN . 31.5 t80 -60.18 -49.54 77.23 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.48 -0.763 . . . . 0.0 109.787 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -62.06 -25.5 67.72 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.671 -1.268 . . . . 0.0 110.671 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.487 HD22 ' HA ' ' A' ' 34' ' ' TYR . 6.5 mp -62.19 -63.75 1.14 Allowed 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.206 -0.934 . . . . 0.0 110.268 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.529 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 69.8 m-70 -106.93 13.47 27.63 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.322 -0.862 . . . . 0.0 110.366 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER 42.98 33.02 0.46 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.679 -0.638 . . . . 0.0 111.219 -179.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 38' ' ' HIS . 5.4 m -136.01 164.72 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 O-C-N 121.15 -0.969 . . . . 0.0 110.176 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -84.45 136.31 33.9 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.438 -0.789 . . . . 0.0 108.974 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.4 ' HA ' ' HD3' ' A' ' 43' ' ' PRO . 2.5 mpt_? -131.78 148.07 68.5 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 121.273 -0.892 . . . . 0.0 109.994 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 42' ' ' ARG . 1.7 Cg_endo -63.02 144.33 92.67 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 122.44 2.093 . . . . 0.0 111.011 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.788 HD22 ' HA ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -84.49 41.63 0.85 Allowed 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.503 -0.748 . . . . 0.0 110.709 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.4 p -63.78 -17.32 62.95 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.136 -0.977 . . . . 0.0 110.373 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 32.6 ttp -97.45 -2.12 42.78 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.122 -0.986 . . . . 0.0 110.609 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.451 ' HB2' ' HB2' ' A' ' 44' ' ' LEU . 1.8 tpt180 -63.64 145.04 56.49 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 120.645 -1.285 . . . . 0.0 110.486 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.97 -176.27 2.86 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.405 -0.809 . . . . 0.0 109.943 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -78.45 -40.7 34.92 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.633 -0.667 . . . . 0.0 110.177 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.43 165.76 19.49 Favored Glycine 0 N--CA 1.5 2.937 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.636 HG21 HG22 ' A' ' 16' ' ' THR . 5.8 mt -58.13 123.78 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.52 -0.988 . . . . 0.0 110.217 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.86 159.29 31.12 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.556 -0.715 . . . . 0.0 109.856 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.98 162.91 40.28 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.272 -0.892 . . . . 0.0 109.275 179.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.415 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -150.59 -161.82 1.42 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.703 -0.623 . . . . 0.0 109.323 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.74 91.83 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.003 -1.061 . . . . 0.0 108.716 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.43 130.69 16.87 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.602 -0.686 . . . . 0.0 110.215 -178.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.496 1.865 0 O-C-N 121.504 -0.748 . . . . 0.0 110.008 -179.735 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.714 0 N-CA-C 109.214 -0.661 . . . . 0.0 109.214 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.84 -45.7 1.14 Allowed Glycine 0 N--CA 1.494 2.563 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.432 ' HB ' ' CZ2' ' A' ' 18' ' ' TRP . 3.9 m -65.43 102.51 0.7 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.118 -1.225 . . . . 0.0 109.503 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.9 m -104.01 113.22 40.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 43.7 t -51.1 107.31 0.17 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 109.536 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.6 m -57.79 -17.77 17.79 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.099 -1.0 . . . . 0.0 110.918 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.505 ' OD1' HG11 ' A' ' 27' ' ' VAL . 3.0 m120 -86.14 -30.88 22.17 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.102 -0.999 . . . . 0.0 111.016 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.5 p -142.72 23.02 1.95 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.571 -1.33 . . . . 0.0 111.437 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 7' ' ' CYS . 13.0 mm100 42.29 35.35 0.6 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.5 -0.75 . . . . 0.0 112.386 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.552 HG22 ' CB ' ' A' ' 7' ' ' CYS . 5.2 t -90.56 135.47 33.68 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.643 -1.286 . . . . 0.0 109.671 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.4 p -93.72 -18.46 22.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.537 -0.727 . . . . 0.0 109.749 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.524 ' HB ' HG13 ' A' ' 51' ' ' ILE . 69.3 p -111.58 126.11 54.65 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.023 -1.048 . . . . 0.0 109.329 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.405 ' O ' HD11 ' A' ' 51' ' ' ILE . 11.9 p -138.44 151.79 47.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.206 -0.934 . . . . 0.0 110.496 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.5 HG22 ' CG2' ' A' ' 51' ' ' ILE . 73.3 p -77.1 -32.75 56.82 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.633 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 52.4 mt -146.46 110.14 4.88 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 179.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.432 ' CZ2' ' HB ' ' A' ' 5' ' ' THR . 13.2 m95 -72.29 120.25 17.63 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.088 -1.008 . . . . 0.0 110.373 -179.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -106.51 82.17 1.69 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.491 -0.755 . . . . 0.0 109.45 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.466 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 6.7 tpp180 -60.95 118.45 6.73 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.418 -0.801 . . . . 0.0 109.377 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.481 ' HB3' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -82.63 143.53 47.41 Favored Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 121.326 -0.858 . . . . 0.0 109.785 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -55.97 -41.8 73.39 Favored 'Trans proline' 0 C--N 1.321 -0.89 0 C-N-CA 122.649 2.233 . . . . 0.0 111.103 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 mmt -56.39 -24.2 43.07 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.261 -0.899 . . . . 0.0 109.506 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.55 36.97 1.5 Allowed Glycine 0 N--CA 1.497 2.745 0 N-CA-C 109.914 -1.275 . . . . 0.0 109.914 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.481 ' O ' ' HB3' ' A' ' 21' ' ' SER . 15.2 m-20 -134.18 99.22 13.58 Favored Pre-proline 0 N--CA 1.495 1.775 0 O-C-N 121.192 -1.181 . . . . 0.0 110.388 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.558 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.8 Cg_endo -63.54 118.67 5.59 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 C-N-CA 122.039 1.826 . . . . 0.0 110.208 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.505 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.1 m -125.28 128.82 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 CA-C-O 121.868 0.842 . . . . 0.0 110.3 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.6 p -53.39 135.51 39.1 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.296 0.57 . . . . 0.0 109.73 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.633 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 22.9 t-20 -38.33 -47.2 1.19 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.627 -0.67 . . . . 0.0 112.035 -178.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.57 -46.13 27.74 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.223 -0.923 . . . . 0.0 110.858 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 22.6 m -65.48 -42.93 91.66 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.256 -0.903 . . . . 0.0 108.789 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.01 -50.37 66.13 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 110.459 -1.056 . . . . 0.0 110.459 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.559 HD23 ' CE ' ' A' ' 36' ' ' LYS . 68.1 mt -59.04 -66.72 0.46 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.369 -1.077 . . . . 0.0 109.608 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.524 ' CZ ' ' HG3' ' A' ' 42' ' ' ARG . 29.8 t80 -43.84 -38.46 3.32 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.558 -0.714 . . . . 0.0 109.687 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.548 ' O ' ' N ' ' A' ' 39' ' ' GLN . 15.9 t80 -62.02 -46.12 90.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.307 -0.87 . . . . 0.0 110.591 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.559 ' CE ' HD23 ' A' ' 33' ' ' LEU . 0.1 OUTLIER -60.37 -22.34 63.19 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.219 -1.551 . . . . 0.0 110.251 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.583 ' N ' HD12 ' A' ' 37' ' ' LEU . 7.2 mp -82.11 -55.54 4.5 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.021 -1.049 . . . . 0.0 110.027 -179.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.471 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 34.5 m-70 -97.44 -27.33 14.5 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.249 -0.907 . . . . 0.0 110.49 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 70.35 24.44 4.71 Favored 'General case' 0 N--CA 1.502 2.168 0 CA-C-O 121.591 0.71 . . . . 0.0 111.204 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.6 m -124.83 164.6 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 121.015 -1.053 . . . . 0.0 109.984 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -83.55 151.6 25.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.513 -0.742 . . . . 0.0 109.773 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.524 ' HG3' ' CZ ' ' A' ' 34' ' ' TYR . 13.2 mmt180 -133.84 147.65 65.11 Favored Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.387 -0.82 . . . . 0.0 110.002 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.479 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 1.0 OUTLIER -65.64 150.41 86.42 Favored 'Trans proline' 0 C--N 1.316 -1.145 0 C-N-CA 122.541 2.161 . . . . 0.0 110.656 179.671 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' ARG . 1.0 OUTLIER -68.6 0.92 3.57 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.192 -0.942 . . . . 0.0 110.876 179.462 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -35.08 45.46 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.936 -1.102 . . . . 0.0 110.257 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.59 -29.14 41.1 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.11 -0.994 . . . . 0.0 109.724 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.472 ' HB3' ' O ' ' A' ' 44' ' ' LEU . 0.5 OUTLIER -50.16 142.6 9.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.325 -0.859 . . . . 0.0 110.09 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.48 172.27 7.63 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.469 -0.769 . . . . 0.0 109.859 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -66.53 -66.25 0.58 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.337 -0.852 . . . . 0.0 109.853 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -117.0 164.4 12.41 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.524 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.0 mt -46.49 123.1 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.468 -1.019 . . . . 0.0 110.311 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -77.18 166.54 23.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.364 -0.835 . . . . 0.0 109.482 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.511 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.67 162.21 40.62 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.335 -0.853 . . . . 0.0 108.985 178.704 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -143.32 -162.06 1.38 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.54 -0.725 . . . . 0.0 109.661 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -62.42 117.14 5.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.98 -1.075 . . . . 0.0 109.089 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.53 134.63 19.27 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.541 -0.725 . . . . 0.0 110.898 -178.862 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt . . . . . 0 N--CA 1.498 1.973 0 O-C-N 121.64 -0.662 . . . . 0.0 109.976 179.838 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.825 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.3 -15.05 7.75 Favored Glycine 0 N--CA 1.497 2.729 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.65 HG23 ' HB2' ' A' ' 26' ' ' PRO . 5.9 m -66.56 92.6 0.21 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.217 -1.167 . . . . 0.0 109.155 179.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 22.3 m -84.66 131.0 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.066 -1.021 . . . . 0.0 108.27 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.539 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 17.3 t -59.02 116.42 3.8 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.288 -0.882 . . . . 0.0 110.765 -178.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.1 m -62.01 -12.46 18.87 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.368 -0.832 . . . . 0.0 110.83 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.697 ' OD1' HG11 ' A' ' 27' ' ' VAL . 7.8 m120 -106.8 -25.31 11.76 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.946 -1.096 . . . . 0.0 111.516 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.616 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 10.8 p -142.69 18.39 2.0 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.65 -1.281 . . . . 0.0 111.255 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 46.83 21.34 0.14 Allowed 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.405 -0.809 . . . . 0.0 112.555 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.564 HG22 ' SG ' ' A' ' 10' ' ' CYS . 7.5 t -87.14 121.83 30.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.513 -1.367 . . . . 0.0 109.849 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.29 -26.67 21.02 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.498 ' HB ' HG13 ' A' ' 51' ' ' ILE . 6.3 p -89.14 96.22 10.63 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.427 -0.796 . . . . 0.0 108.958 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.53 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 5.3 p -118.02 166.41 12.57 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.014 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.508 HG22 HG21 ' A' ' 51' ' ' ILE . 69.4 p -96.02 -38.06 10.37 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.698 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 17.0 mt -137.4 90.56 2.52 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.305 -0.872 . . . . 0.0 108.662 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.53 ' CZ2' HG23 ' A' ' 15' ' ' THR . 10.8 m95 -54.12 113.59 1.3 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.118 -0.989 . . . . 0.0 110.433 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.483 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 3.0 tpp180 -99.75 86.18 3.26 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.276 -0.89 . . . . 0.0 109.014 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.408 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.4 mmm180 -71.2 90.93 0.92 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.281 -0.887 . . . . 0.0 109.019 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.3 t -55.24 142.65 57.98 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.456 -0.777 . . . . 0.0 110.254 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -56.68 -30.89 85.68 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 C-N-CA 122.682 2.254 . . . . 0.0 110.976 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.28 -22.99 62.02 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.314 -0.866 . . . . 0.0 109.534 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.35 40.74 1.6 Allowed Glycine 0 N--CA 1.496 2.685 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -136.18 105.05 9.47 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.246 -1.15 . . . . 0.0 110.347 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.65 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.3 Cg_endo -64.98 91.96 0.2 Allowed 'Trans proline' 0 C--N 1.314 -1.283 0 C-N-CA 122.337 2.025 . . . . 0.0 109.914 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.697 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.5 m -109.99 125.61 67.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.057 -1.027 . . . . 0.0 110.573 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.502 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.6 p -49.21 133.5 19.06 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.591 -0.693 . . . . 0.0 110.189 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.698 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 4.7 t-20 -39.92 -40.16 0.96 Allowed 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.577 -0.702 . . . . 0.0 111.586 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.54 -43.27 65.08 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.113 -0.992 . . . . 0.0 110.047 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 6.5 m -64.29 -41.52 96.83 Favored 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.55 -36.55 93.36 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 178.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 83.5 mt -73.3 -62.97 1.29 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.545 -0.974 . . . . 0.0 110.168 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.675 ' HA ' HD22 ' A' ' 37' ' ' LEU . 89.2 t80 -51.81 -34.43 40.16 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.128 -0.983 . . . . 0.0 109.141 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.469 ' O ' ' N ' ' A' ' 39' ' ' GLN . 36.0 t80 -58.0 -52.68 64.52 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.428 -0.795 . . . . 0.0 109.22 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 tttp -55.08 -31.33 61.1 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.074 -1.016 . . . . 0.0 110.433 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.675 HD22 ' HA ' ' A' ' 34' ' ' TYR . 2.2 mp -61.29 -68.11 0.34 Allowed 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.215 -0.928 . . . . 0.0 110.576 -179.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CB ' HG22 ' A' ' 40' ' ' VAL . 75.6 m-70 -96.9 10.0 40.32 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.053 -1.03 . . . . 0.0 110.412 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.491 ' HG3' ' O ' ' A' ' 38' ' ' HIS . 1.9 pt20 45.14 31.32 0.74 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.643 -0.661 . . . . 0.0 111.09 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.6 m -127.96 -170.01 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 121.351 -0.843 . . . . 0.0 109.582 179.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -60.62 178.63 0.21 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.274 -0.891 . . . . 0.0 110.558 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.461 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -131.52 106.43 14.42 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.073 -1.017 . . . . 0.0 109.915 -179.031 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -60.08 133.98 53.45 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 C-N-CA 122.387 2.058 . . . . 0.0 111.162 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.619 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -91.01 -1.6 57.79 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.288 -0.882 . . . . 0.0 110.928 -179.83 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 45' ' ' THR . 3.1 p -58.07 -16.68 13.84 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.067 -1.02 . . . . 0.0 110.903 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 18.0 ttp -94.84 -5.16 45.69 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.885 -1.134 . . . . 0.0 111.036 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.462 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -81.08 168.99 18.01 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 120.549 -1.344 . . . . 0.0 110.335 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -132.85 -174.83 3.58 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.226 -0.921 . . . . 0.0 109.735 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -77.09 -17.91 58.37 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.492 -0.755 . . . . 0.0 110.481 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.48 148.76 19.62 Favored Glycine 0 N--CA 1.5 2.944 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.508 HG21 HG22 ' A' ' 16' ' ' THR . 5.0 mt -53.33 110.44 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.311 -1.111 . . . . 0.0 110.091 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -47.03 123.19 5.04 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.831 -0.543 . . . . 0.0 109.955 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.58 156.44 42.43 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.005 -1.06 . . . . 0.0 110.51 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.38 -154.85 0.55 Allowed 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -62.98 87.05 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.045 -1.035 . . . . 0.0 108.615 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.9 ptt180 -50.81 156.55 0.94 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.397 -0.814 . . . . 0.0 110.715 -178.743 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? . . . . . 0 N--CA 1.496 1.861 0 O-C-N 121.628 -0.67 . . . . 0.0 109.794 179.638 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.879 0 N-CA-C 109.343 -0.614 . . . . 0.0 109.343 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.6 -35.48 4.98 Favored Glycine 0 N--CA 1.498 2.791 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.473 HG23 ' CB ' ' A' ' 26' ' ' PRO . 58.8 m -72.13 93.17 1.4 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.341 -1.093 . . . . 0.0 109.21 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.2 m -86.19 130.16 37.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.506 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 42.6 t -61.31 115.3 3.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.118 -0.988 . . . . 0.0 110.564 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.2 m -62.02 -12.73 20.27 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.416 -0.803 . . . . 0.0 110.864 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.449 ' ND2' HG11 ' A' ' 27' ' ' VAL . 57.2 m-20 -101.59 -30.14 11.55 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.068 -1.02 . . . . 0.0 110.989 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 14.5 p -141.51 26.06 1.98 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.625 -1.297 . . . . 0.0 111.336 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.632 ' HB2' HD22 ' A' ' 44' ' ' LEU . 12.4 mt-30 41.82 20.93 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.613 0 O-C-N 121.307 -0.871 . . . . 0.0 113.163 178.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.48 HG22 ' SG ' ' A' ' 10' ' ' CYS . 7.3 t -85.64 132.96 34.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.411 -1.431 . . . . 0.0 109.945 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.0 t -90.66 -30.41 17.16 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.534 -0.729 . . . . 0.0 109.313 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.5 p -89.98 131.38 35.9 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.332 -0.855 . . . . 0.0 108.861 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.493 ' C ' HD11 ' A' ' 51' ' ' ILE . 19.9 p -148.74 155.8 41.49 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.055 -1.028 . . . . 0.0 110.205 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 27.2 p -75.05 -44.86 45.28 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.016 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 9.2 mt -144.84 114.05 7.0 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.116 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.415 ' CZ2' ' O ' ' A' ' 5' ' ' THR . 15.7 m95 -65.97 103.38 0.93 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.308 -0.87 . . . . 0.0 110.273 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.486 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 3.8 tpp180 -81.35 71.36 8.34 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.492 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.43 105.07 0.47 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.287 -0.883 . . . . 0.0 109.464 -179.595 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.419 ' OG ' ' HD2' ' A' ' 22' ' ' PRO . 0.3 OUTLIER -66.88 147.76 99.0 Favored Pre-proline 0 N--CA 1.501 2.113 0 O-C-N 121.295 -0.878 . . . . 0.0 110.193 -179.394 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.419 ' HD2' ' OG ' ' A' ' 21' ' ' SER . 6.2 Cg_exo -54.95 -38.06 93.14 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.586 2.191 . . . . 0.0 111.105 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -23.59 56.32 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.314 -0.867 . . . . 0.0 109.584 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.74 36.98 1.63 Allowed Glycine 0 N--CA 1.497 2.749 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -123.38 101.0 38.09 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.018 -1.283 . . . . 0.0 110.426 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 2.4 Cg_endo -65.05 91.4 0.2 Allowed 'Trans proline' 0 C--N 1.312 -1.364 0 C-N-CA 122.214 1.943 . . . . 0.0 110.096 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.506 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.6 m -109.24 127.48 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.249 -0.907 . . . . 0.0 110.04 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.44 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 9.2 p -51.55 134.1 29.68 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.666 -0.646 . . . . 0.0 109.622 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -39.88 -44.91 1.73 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.546 -0.722 . . . . 0.0 111.545 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.95 -44.17 50.46 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.475 -0.765 . . . . 0.0 110.48 -179.639 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.6 m -61.59 -46.69 88.77 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.294 -0.879 . . . . 0.0 108.918 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -54.75 -38.59 64.63 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.2 mt -77.73 -60.56 2.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.422 -1.046 . . . . 0.0 109.739 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.643 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 32.9 t80 -49.52 -40.15 36.74 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.331 -0.856 . . . . 0.0 109.443 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.457 ' O ' ' N ' ' A' ' 39' ' ' GLN . 27.2 t80 -56.15 -49.37 74.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.511 -0.743 . . . . 0.0 109.44 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -32.27 69.09 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 120.869 -1.144 . . . . 0.0 110.049 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 34' ' ' TYR . 4.8 mp -60.37 -67.87 0.35 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.194 -0.941 . . . . 0.0 110.593 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.663 ' O ' HG22 ' A' ' 40' ' ' VAL . 56.3 m-70 -95.16 9.83 38.17 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.147 -0.97 . . . . 0.0 110.2 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 8.2 pt20 46.65 29.07 0.88 Allowed 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.655 -0.653 . . . . 0.0 111.29 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 38' ' ' HIS . 4.6 m -141.55 165.66 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 121.315 -0.866 . . . . 0.0 109.816 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.79 166.94 15.67 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.194 -0.941 . . . . 0.0 109.581 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.643 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 1.2 mmt180 -147.43 150.29 36.91 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.035 -1.041 . . . . 0.0 109.801 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.5 ' HD2' ' CD ' ' A' ' 42' ' ' ARG . 6.1 Cg_exo -56.54 150.25 52.97 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 C-N-CA 122.341 2.027 . . . . 0.0 110.584 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.632 HD22 ' HB2' ' A' ' 11' ' ' GLN . 1.2 pp -74.64 1.36 12.38 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.372 -0.83 . . . . 0.0 111.459 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.2 t -59.5 -14.76 14.01 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 120.817 -1.177 . . . . 0.0 110.766 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.3 ttt -72.81 -37.43 67.51 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.918 -1.114 . . . . 0.0 110.489 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.483 ' CZ ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -81.75 169.77 16.53 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.095 -1.003 . . . . 0.0 110.229 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -122.41 -169.9 1.98 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.125 -0.984 . . . . 0.0 110.229 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.72 -82.33 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.582 -0.699 . . . . 0.0 110.92 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -87.37 165.89 35.99 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.493 HD11 ' C ' ' A' ' 15' ' ' THR . 5.9 mt -54.3 136.63 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.003 -1.292 . . . . 0.0 110.109 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -66.36 138.09 57.35 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.677 -0.639 . . . . 0.0 109.825 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.85 163.63 38.97 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.093 -1.004 . . . . 0.0 109.593 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.87 -157.42 0.81 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.507 -0.745 . . . . 0.0 109.294 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -59.67 135.14 57.59 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.968 -1.082 . . . . 0.0 109.487 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 10.0 tpp180 -55.22 140.56 38.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.596 -0.69 . . . . 0.0 110.216 -179.431 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.492 1.643 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.693 0 N-CA-C 108.839 -0.8 . . . . 0.0 108.839 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.511 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 95.74 -30.14 8.83 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.348 -1.501 . . . . 0.0 109.348 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.514 HG23 ' CB ' ' A' ' 26' ' ' PRO . 11.2 m -58.31 93.46 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.231 -1.158 . . . . 0.0 109.063 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 4' ' ' GLY . 13.7 m -85.28 140.16 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.133 -0.979 . . . . 0.0 108.794 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.705 ' HB2' HG22 ' A' ' 12' ' ' THR . 31.4 t -64.67 120.36 12.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.161 -0.962 . . . . 0.0 110.252 -179.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 m -63.23 -14.03 44.63 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.392 -0.817 . . . . 0.0 110.427 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -107.64 -17.18 14.16 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.996 -1.065 . . . . 0.0 111.146 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.51 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 8.4 p -154.01 24.31 0.5 Allowed 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.565 -1.335 . . . . 0.0 111.116 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 7.7 pt20 33.73 34.41 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.605 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 178.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.705 HG22 ' HB2' ' A' ' 7' ' ' CYS . 6.1 t -83.79 131.33 34.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.541 -1.349 . . . . 0.0 109.165 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.3 p -89.28 -1.1 57.94 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.315 -0.865 . . . . 0.0 109.18 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.5 p -128.35 132.25 48.59 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.489 -0.757 . . . . 0.0 109.241 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.528 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 5.7 p -144.9 158.77 43.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.306 -0.871 . . . . 0.0 109.543 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.606 HG22 HG21 ' A' ' 51' ' ' ILE . 48.8 p -85.95 -26.99 25.21 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.663 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 59.9 mt -146.48 94.62 2.47 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.528 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.7 m95 -57.8 115.6 2.92 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.969 -1.082 . . . . 0.0 110.395 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.27 92.61 4.28 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.314 -0.866 . . . . 0.0 109.289 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.482 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -80.47 104.87 11.3 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.0 109.239 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.4 m -64.05 148.11 95.7 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.145 -0.972 . . . . 0.0 110.123 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -55.37 -44.92 44.13 Favored 'Trans proline' 0 C--N 1.319 -1.016 0 C-N-CA 122.771 2.314 . . . . 0.0 111.191 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 41.2 mtt -57.76 -21.54 41.96 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.236 -0.915 . . . . 0.0 110.153 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.444 ' HA2' ' NH1' ' A' ' 20' ' ' ARG . . . 111.04 45.36 0.88 Allowed Glycine 0 N--CA 1.497 2.716 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -128.34 92.68 40.54 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.572 -0.958 . . . . 0.0 110.172 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.514 ' CB ' HG23 ' A' ' 5' ' ' THR . 2.7 Cg_endo -63.47 95.63 0.18 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.08 1.854 . . . . 0.0 109.728 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.524 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.04 124.22 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.099 -1.0 . . . . 0.0 110.617 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.493 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.3 p -49.17 136.15 15.56 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.653 -0.654 . . . . 0.0 109.867 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.663 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 12.2 t-20 -40.2 -41.08 1.23 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.661 -0.65 . . . . 0.0 111.465 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.44 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -50.83 -45.81 59.74 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.372 -0.83 . . . . 0.0 110.265 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.454 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 34.6 m -67.92 -39.83 83.47 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.288 -0.882 . . . . 0.0 108.751 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.95 -39.21 95.28 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 65.0 mt -74.72 -60.74 2.14 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.415 -1.05 . . . . 0.0 109.881 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.568 ' CE1' ' HB3' ' A' ' 42' ' ' ARG . 47.3 t80 -49.22 -37.84 24.4 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.378 -0.826 . . . . 0.0 109.106 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.522 ' O ' ' N ' ' A' ' 39' ' ' GLN . 15.9 t80 -62.08 -52.88 62.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.543 -0.723 . . . . 0.0 109.659 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.42 -29.13 14.84 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.651 -1.28 . . . . 0.0 110.434 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.32 -63.39 1.07 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.027 -1.046 . . . . 0.0 110.862 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.454 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 9.7 m-70 -97.42 -32.44 11.85 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.126 -0.984 . . . . 0.0 110.214 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 81.87 26.73 0.18 Allowed 'General case' 0 N--CA 1.504 2.265 0 CA-C-O 121.699 0.761 . . . . 0.0 110.689 -179.853 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.6 m -130.63 168.18 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 O-C-N 120.857 -1.152 . . . . 0.0 109.754 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -73.32 146.82 44.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.21 -0.931 . . . . 0.0 109.18 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.568 ' HB3' ' CE1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -128.5 149.94 73.12 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.069 -1.02 . . . . 0.0 110.456 -179.346 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.423 ' O ' ' HD3' ' A' ' 42' ' ' ARG . 2.1 Cg_endo -62.33 135.67 55.28 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 C-N-CA 122.506 2.137 . . . . 0.0 111.091 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.51 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -84.54 29.54 0.59 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.367 -0.833 . . . . 0.0 111.063 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.0 t -61.21 -17.4 53.03 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.751 -1.218 . . . . 0.0 110.473 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.51 -7.53 57.48 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.899 -1.126 . . . . 0.0 110.608 179.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.447 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -73.34 113.52 10.51 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.61 -1.307 . . . . 0.0 109.251 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.84 -156.25 0.57 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.474 -0.767 . . . . 0.0 110.172 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -73.91 0.12 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.472 -0.768 . . . . 0.0 110.328 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -102.84 174.04 23.11 Favored Glycine 0 N--CA 1.497 2.715 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.606 HG21 HG22 ' A' ' 16' ' ' THR . 6.1 mt -59.02 135.26 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.279 -1.13 . . . . 0.0 110.005 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -69.84 161.6 29.57 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.448 -0.782 . . . . 0.0 110.133 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.51 168.75 26.42 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.38 -0.825 . . . . 0.0 109.048 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.89 -169.37 3.36 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.259 -0.9 . . . . 0.0 109.203 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -56.17 100.13 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.947 -1.096 . . . . 0.0 108.704 179.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -46.43 127.15 8.88 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.572 -0.705 . . . . 0.0 110.7 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt . . . . . 0 N--CA 1.495 1.788 0 O-C-N 121.72 -0.612 . . . . 0.0 110.061 -179.97 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.838 0 CA-C-O 121.287 0.565 . . . . 0.0 109.974 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.98 0.86 65.69 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.628 HG22 ' CH2' ' A' ' 18' ' ' TRP . 53.5 m -81.46 84.92 6.57 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.862 -1.375 . . . . 0.0 109.976 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 6' ' ' VAL . 21.9 m -85.23 114.69 25.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 178.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.652 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 1.7 t -42.61 113.22 0.44 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.45 -0.781 . . . . 0.0 110.932 -178.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . 0.537 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 53.5 m -65.51 -12.58 54.09 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.134 -0.979 . . . . 0.0 111.276 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.826 ' HB2' HG12 ' A' ' 27' ' ' VAL . 0.7 OUTLIER -103.38 -24.84 13.46 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.955 -1.09 . . . . 0.0 110.583 179.833 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.518 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 9.2 p -144.7 25.83 1.44 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.88 -1.137 . . . . 0.0 110.767 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.812 ' HB2' HD22 ' A' ' 44' ' ' LEU . 0.0 OUTLIER 38.96 25.6 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.367 -0.833 . . . . 0.0 113.028 178.781 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' ' 7' ' ' CYS . 5.4 t -89.08 131.2 35.34 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.412 -1.43 . . . . 0.0 109.218 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.2 p -90.03 -29.82 18.15 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.493 ' HB ' ' CG1' ' A' ' 51' ' ' ILE . 2.9 p -93.79 124.8 38.03 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.419 -0.801 . . . . 0.0 109.438 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.601 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 11.9 p -134.01 140.15 46.51 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.35 -0.844 . . . . 0.0 109.244 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.517 HG22 HG21 ' A' ' 51' ' ' ILE . 70.4 p -62.14 -36.86 83.07 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 179.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.469 HD23 ' HA ' ' A' ' 17' ' ' LEU . 13.2 mt -149.56 112.28 4.79 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.628 ' CH2' HG22 ' A' ' 5' ' ' THR . 13.8 m95 -59.58 123.44 16.9 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.495 -0.753 . . . . 0.0 110.112 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.576 ' O ' HG23 ' A' ' 27' ' ' VAL . 2.0 ttm180 -116.34 74.47 0.9 Allowed 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.73 119.5 11.31 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.939 -1.101 . . . . 0.0 109.503 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.436 ' OG ' HG22 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -86.91 142.62 34.28 Favored Pre-proline 0 N--CA 1.501 2.085 0 O-C-N 121.016 -1.053 . . . . 0.0 110.006 -179.67 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -56.27 -28.67 72.7 Favored 'Trans proline' 0 C--N 1.32 -0.946 0 C-N-CA 122.722 2.281 . . . . 0.0 110.981 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.5 mtp -55.45 -25.11 34.62 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.469 -0.77 . . . . 0.0 109.63 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.14 35.31 2.55 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.657 -1.377 . . . . 0.0 109.657 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -137.8 108.38 8.4 Favored Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 121.381 -1.07 . . . . 0.0 109.966 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.537 ' HD2' ' OG ' ' A' ' 8' ' ' SER . 2.9 Cg_endo -60.7 99.7 0.15 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 C-N-CA 121.786 1.657 . . . . 0.0 110.087 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.826 HG12 ' HB2' ' A' ' 9' ' ' ASN . 2.1 m -109.97 147.51 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.173 -0.954 . . . . 0.0 109.745 179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.448 ' N ' ' SG ' ' A' ' 7' ' ' CYS . 30.4 p -83.5 153.65 24.3 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.286 -0.884 . . . . 0.0 108.656 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.513 ' OD1' HD12 ' A' ' 33' ' ' LEU . 11.2 t-20 -41.36 -42.56 2.27 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.562 -0.712 . . . . 0.0 110.079 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.67 -43.46 97.62 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.32 -0.863 . . . . 0.0 110.794 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 1.7 m -58.97 -44.21 91.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.099 -1.001 . . . . 0.0 108.924 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -68.82 -38.78 85.69 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 36.3 mt -69.5 -66.07 0.63 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.373 -1.075 . . . . 0.0 110.609 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HA ' HD13 ' A' ' 37' ' ' LEU . 80.2 t80 -49.91 -35.29 23.24 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.98 -1.075 . . . . 0.0 109.57 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.572 ' CE1' ' HG3' ' A' ' 39' ' ' GLN . 29.4 t80 -61.76 -47.7 84.0 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.338 -0.851 . . . . 0.0 109.838 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -57.51 -24.36 55.52 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 120.038 -1.664 . . . . 0.0 110.633 179.528 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.593 HD13 ' HA ' ' A' ' 34' ' ' TYR . 2.3 mp -70.78 -67.55 0.5 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.999 -1.063 . . . . 0.0 110.189 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.445 ' HB2' HG22 ' A' ' 40' ' ' VAL . 12.8 m-70 -97.29 -22.12 16.85 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.198 -0.939 . . . . 0.0 110.147 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.572 ' HG3' ' CE1' ' A' ' 35' ' ' TYR . 1.1 tt0 65.27 48.75 2.08 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 121.913 0.863 . . . . 0.0 110.438 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.4 m -142.21 169.54 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 O-C-N 121.294 -0.879 . . . . 0.0 109.012 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.4 p-10 -83.92 150.57 25.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.992 -1.067 . . . . 0.0 108.852 179.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.498 ' HG3' ' HD2' ' A' ' 43' ' ' PRO . 64.4 ttt180 -145.08 137.99 13.83 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 120.818 -1.176 . . . . 0.0 110.236 -179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.498 ' HD2' ' HG3' ' A' ' 42' ' ' ARG . 3.3 Cg_exo -59.94 151.18 73.58 Favored 'Trans proline' 0 C--N 1.317 -1.126 0 C-N-CA 122.462 2.108 . . . . 0.0 110.415 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.812 HD22 ' HB2' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -83.14 40.52 0.71 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.06 -1.025 . . . . 0.0 111.144 -179.395 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.4 p -70.78 -10.13 58.86 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.913 -1.117 . . . . 0.0 110.309 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.0 ttm -102.3 -19.42 15.02 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.035 -1.041 . . . . 0.0 110.765 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 1.9 mpt_? -81.64 175.24 10.64 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.856 -1.153 . . . . 0.0 110.171 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.7 166.09 29.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.31 -0.868 . . . . 0.0 109.696 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -58.07 -28.25 64.37 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.309 -0.869 . . . . 0.0 110.342 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -109.17 123.39 6.88 Favored Glycine 0 N--CA 1.497 2.722 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.517 HG21 HG22 ' A' ' 16' ' ' THR . 5.5 mt -53.37 136.6 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.418 -1.048 . . . . 0.0 110.075 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.81 146.27 40.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.505 -0.747 . . . . 0.0 110.001 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.25 158.82 39.44 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.117 -0.989 . . . . 0.0 109.433 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -151.31 -162.39 1.53 Allowed 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -54.13 103.63 0.09 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.841 -1.162 . . . . 0.0 108.921 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -55.73 160.99 2.32 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.55 -0.719 . . . . 0.0 110.672 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm . . . . . 0 N--CA 1.492 1.627 0 O-C-N 121.473 -0.767 . . . . 0.0 110.045 179.758 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.791 0 N-CA-C 109.447 -0.575 . . . . 0.0 109.447 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.468 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 106.21 -28.61 13.12 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 108.944 -1.662 . . . . 0.0 108.944 -178.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.496 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 27.8 m -60.13 92.16 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.409 -1.054 . . . . 0.0 109.524 179.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 6' ' ' VAL . 35.3 m -93.33 119.0 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.956 ' HB2' HG22 ' A' ' 12' ' ' THR . 9.3 t -46.8 114.93 0.92 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.454 -0.778 . . . . 0.0 110.809 -178.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.4 m -63.13 -14.62 50.76 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.231 -0.918 . . . . 0.0 110.03 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -98.7 -29.16 13.18 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.103 -0.998 . . . . 0.0 110.918 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.601 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 10.4 p -143.16 25.79 1.71 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.649 -1.282 . . . . 0.0 111.456 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.415 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER 37.15 35.54 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.592 -0.693 . . . . 0.0 112.76 178.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.956 HG22 ' HB2' ' A' ' 7' ' ' CYS . 9.5 t -88.27 138.27 31.59 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.704 -1.248 . . . . 0.0 109.464 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.3 p -101.13 -19.79 15.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.344 -0.848 . . . . 0.0 109.627 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.447 ' HB ' HG13 ' A' ' 51' ' ' ILE . 12.0 p -108.97 113.08 25.65 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.512 -0.743 . . . . 0.0 109.537 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.626 ' C ' HD11 ' A' ' 51' ' ' ILE . 4.8 p -132.83 147.41 52.3 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.212 -0.93 . . . . 0.0 110.143 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.627 HG22 HG21 ' A' ' 51' ' ' ILE . 29.9 p -73.57 -28.06 61.65 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.501 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 18.8 mt -149.81 120.24 7.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.515 -0.741 . . . . 0.0 109.196 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.468 ' CH2' HG21 ' A' ' 15' ' ' THR . 8.5 m95 -84.68 117.97 24.11 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.427 -0.796 . . . . 0.0 109.796 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.568 ' HD2' ' HA ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -108.7 103.36 12.44 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.156 -0.965 . . . . 0.0 109.14 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.466 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 2.0 mmt180 -77.33 119.61 21.21 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.326 -0.859 . . . . 0.0 109.729 -179.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 55.7 m -75.33 149.75 84.57 Favored Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.334 -0.854 . . . . 0.0 110.113 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -53.66 -47.76 25.51 Favored 'Trans proline' 0 C--N 1.321 -0.9 0 C-N-CA 122.793 2.328 . . . . 0.0 111.147 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 7.6 ttt -55.71 -25.55 40.68 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.291 -0.881 . . . . 0.0 109.435 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 114.49 45.62 0.66 Allowed Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -132.11 102.98 14.24 Favored Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.288 -1.125 . . . . 0.0 111.026 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.496 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 2.5 Cg_endo -65.42 105.14 0.7 Allowed 'Trans proline' 0 C--N 1.315 -1.231 0 C-N-CA 122.323 2.015 . . . . 0.0 109.7 178.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.539 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -116.45 126.69 74.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.317 -0.864 . . . . 0.0 110.736 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.45 ' HB3' ' CG2' ' A' ' 12' ' ' THR . 8.1 p -49.92 139.91 12.89 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.648 -0.658 . . . . 0.0 109.787 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.568 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 18.2 t-20 -43.13 -46.71 5.95 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.357 -0.839 . . . . 0.0 112.218 -178.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -46.43 -45.97 18.44 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.346 -0.846 . . . . 0.0 110.615 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 9.9 m -63.23 -44.92 93.9 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.682 -0.636 . . . . 0.0 109.37 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.47 -49.36 77.94 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 42.2 mt -67.04 -60.6 2.49 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.473 -1.016 . . . . 0.0 109.938 -179.614 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.483 ' CE2' ' HD3' ' A' ' 42' ' ' ARG . 50.6 t80 -51.41 -43.24 61.93 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.567 -0.708 . . . . 0.0 109.619 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.531 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 47.6 t80 -53.38 -47.33 69.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.411 -0.806 . . . . 0.0 108.866 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -43.09 99.58 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.057 -1.027 . . . . 0.0 110.358 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 9.6 mp -40.86 -56.62 2.17 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 121.506 -0.747 . . . . 0.0 110.705 -179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.479 ' HB2' HG22 ' A' ' 40' ' ' VAL . 41.2 m-70 -115.1 6.46 15.17 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.171 -0.956 . . . . 0.0 110.288 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 35' ' ' TYR . 1.7 tm0? 49.36 34.71 6.77 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.397 -0.815 . . . . 0.0 110.13 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.479 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.7 m -141.05 167.14 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 O-C-N 121.121 -0.987 . . . . 0.0 110.17 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -84.53 156.35 21.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.505 -0.747 . . . . 0.0 109.747 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.508 ' CG ' ' HD2' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -151.08 152.07 30.7 Favored Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.296 -0.878 . . . . 0.0 109.545 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.508 ' HD2' ' CG ' ' A' ' 42' ' ' ARG . 4.6 Cg_exo -55.41 143.78 75.63 Favored 'Trans proline' 0 C--N 1.316 -1.174 0 C-N-CA 122.313 2.009 . . . . 0.0 111.147 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.601 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -95.46 37.71 1.18 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.464 -0.773 . . . . 0.0 110.561 -179.582 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -70.57 -6.64 37.97 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.946 -1.096 . . . . 0.0 110.038 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 38.1 mtp -92.15 -16.0 26.89 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.979 -1.075 . . . . 0.0 110.303 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.58 ' HG2' ' HB2' ' A' ' 44' ' ' LEU . 25.3 mmm180 -56.43 151.28 13.49 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.728 -1.232 . . . . 0.0 109.591 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -139.53 155.35 47.57 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.447 -0.783 . . . . 0.0 109.871 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -49.67 -77.59 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.616 -0.678 . . . . 0.0 110.49 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -83.4 148.4 25.16 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.627 HG21 HG22 ' A' ' 16' ' ' THR . 10.1 mt -54.25 136.89 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.324 -1.104 . . . . 0.0 109.773 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.446 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -75.48 156.0 35.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.552 -0.718 . . . . 0.0 109.836 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.446 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.99 163.01 40.24 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.439 -0.788 . . . . 0.0 109.045 178.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.423 ' HD3' ' HA ' ' A' ' 54' ' ' ARG . 15.6 mmt180 -147.67 -165.81 2.36 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -57.35 111.0 0.95 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.823 -1.173 . . . . 0.0 108.863 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -46.21 128.3 9.48 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.332 -0.855 . . . . 0.0 111.111 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt . . . . . 0 N--CA 1.496 1.851 0 O-C-N 121.637 -0.664 . . . . 0.0 109.322 179.469 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.732 0 N-CA-C 109.303 -0.629 . . . . 0.0 109.303 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.91 -37.9 2.08 Favored Glycine 0 N--CA 1.495 2.625 0 N-CA-C 108.909 -1.676 . . . . 0.0 108.909 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.417 ' O ' ' CH2' ' A' ' 18' ' ' TRP . 65.8 m -66.53 89.08 0.14 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.362 -1.081 . . . . 0.0 109.264 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 6' ' ' VAL . 28.7 m -85.15 109.72 18.48 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.523 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 53.9 t -45.17 113.55 0.59 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.338 -0.851 . . . . 0.0 110.266 -178.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.4 m -63.23 -6.78 4.81 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.366 -0.833 . . . . 0.0 111.285 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.412 ' CG ' HG11 ' A' ' 27' ' ' VAL . 1.6 m120 -102.9 -31.01 10.47 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.795 -1.19 . . . . 0.0 110.728 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.623 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 17.7 p -138.19 18.84 2.78 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.812 -1.18 . . . . 0.0 111.003 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.82 25.51 0.46 Allowed 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.351 -0.843 . . . . 0.0 111.615 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.426 HG22 ' CB ' ' A' ' 7' ' ' CYS . 5.8 t -88.6 132.53 34.5 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.67 -1.268 . . . . 0.0 109.525 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 p -92.68 -6.66 48.77 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.592 -0.693 . . . . 0.0 109.25 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.0 p -112.69 128.86 56.52 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.33 -0.856 . . . . 0.0 109.686 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.547 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 5.4 p -149.07 152.56 36.42 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.059 -1.025 . . . . 0.0 109.883 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.601 HG22 HG21 ' A' ' 51' ' ' ILE . 19.5 p -83.65 -31.06 26.38 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.6 -0.687 . . . . 0.0 109.461 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.669 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 24.9 mt -141.48 87.4 2.07 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.392 -0.818 . . . . 0.0 108.873 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.547 ' CZ2' HG23 ' A' ' 15' ' ' THR . 11.5 m95 -53.32 103.14 0.07 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.247 -0.908 . . . . 0.0 110.357 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.504 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 2.3 tpt180 -88.61 83.94 6.75 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.35 -0.844 . . . . 0.0 109.259 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.8 tpp180 -71.44 114.64 9.72 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.299 -0.876 . . . . 0.0 108.903 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 26.4 p -84.01 139.6 39.85 Favored Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.178 -0.951 . . . . 0.0 109.573 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -55.86 -31.79 82.51 Favored 'Trans proline' 0 C--N 1.319 -1.011 0 C-N-CA 122.589 2.193 . . . . 0.0 111.053 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -23.81 44.88 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.436 -0.79 . . . . 0.0 109.343 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.11 28.19 3.95 Favored Glycine 0 N--CA 1.496 2.664 0 N-CA-C 109.994 -1.242 . . . . 0.0 109.994 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -129.47 99.79 20.65 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.052 -1.263 . . . . 0.0 110.14 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.472 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 Cg_endo -66.09 108.04 1.25 Allowed 'Trans proline' 0 C--N 1.314 -1.278 0 C-N-CA 122.216 1.944 . . . . 0.0 109.818 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.523 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.8 m -121.12 125.9 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.109 -0.994 . . . . 0.0 110.351 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.534 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.9 p -51.4 131.84 29.04 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.56 -0.713 . . . . 0.0 109.514 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.669 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 6.0 t-20 -41.97 -40.37 2.17 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.486 -0.759 . . . . 0.0 111.725 -178.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.35 -38.43 53.14 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.113 -0.992 . . . . 0.0 109.79 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.57 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 2.3 m -68.06 -42.22 80.8 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.65 -57.04 17.92 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 30.4 mt -59.71 -42.88 94.06 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.512 -0.993 . . . . 0.0 109.006 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -57.95 -42.58 85.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.353 -0.842 . . . . 0.0 109.268 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.569 ' HB2' ' NE ' ' A' ' 42' ' ' ARG . 41.4 t80 -55.79 -36.3 67.24 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.305 -0.872 . . . . 0.0 110.169 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -79.29 -49.93 11.69 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.75 -1.219 . . . . 0.0 110.092 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -49.34 -33.01 12.4 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.326 -0.859 . . . . 0.0 110.219 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.524 ' CB ' HG22 ' A' ' 40' ' ' VAL . 16.3 m-70 -118.3 -6.18 10.82 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.137 -0.977 . . . . 0.0 110.64 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.47 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.4 OUTLIER 50.07 34.88 8.9 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.096 -1.002 . . . . 0.0 109.937 -179.295 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.524 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.4 m -138.71 -169.11 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 O-C-N 121.271 -0.893 . . . . 0.0 109.383 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -176.02 0.05 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.27 -0.894 . . . . 0.0 109.771 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.57 ' HG2' ' O ' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -135.63 86.26 28.87 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.011 -1.056 . . . . 0.0 110.047 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -64.79 147.26 89.52 Favored 'Trans proline' 0 C--N 1.314 -1.279 0 C-N-CA 122.367 2.045 . . . . 0.0 110.46 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.635 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.7 OUTLIER -91.34 12.78 19.32 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.093 -1.004 . . . . 0.0 110.523 179.661 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 p -53.96 -26.12 24.14 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 120.955 -1.091 . . . . 0.0 110.611 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 8.1 ttp -94.61 -6.65 43.0 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.197 -0.939 . . . . 0.0 110.845 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.481 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -81.47 162.4 23.29 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.931 -1.105 . . . . 0.0 110.395 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.534 ' HD2' ' HG3' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -146.18 -173.56 4.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.525 -0.734 . . . . 0.0 109.118 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.71 -9.05 58.18 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.383 -0.823 . . . . 0.0 111.598 -179.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -141.53 149.74 21.34 Favored Glycine 0 N--CA 1.501 3.026 0 O-C-N 120.53 -1.356 . . . . 0.0 110.727 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.601 HG21 HG22 ' A' ' 16' ' ' THR . 4.7 mt -63.6 131.76 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.379 -1.071 . . . . 0.0 109.567 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.534 ' HG3' ' HD2' ' A' ' 48' ' ' LYS . 3.6 mt-30 -63.73 136.85 57.77 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.335 -0.853 . . . . 0.0 110.145 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.61 160.67 40.63 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.102 -0.999 . . . . 0.0 109.853 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.51 -155.67 0.63 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -56.39 114.96 2.22 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.835 -1.165 . . . . 0.0 108.503 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.3 ttm180 -51.78 143.13 13.59 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.508 -0.745 . . . . 0.0 110.773 -178.757 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt . . . . . 0 N--CA 1.494 1.764 0 O-C-N 121.503 -0.748 . . . . 0.0 109.529 179.558 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.817 0 N-CA-C 109.544 -0.539 . . . . 0.0 109.544 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.27 -31.93 8.16 Favored Glycine 0 N--CA 1.495 2.584 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.503 HG23 ' CB ' ' A' ' 26' ' ' PRO . 55.1 m -66.59 93.97 0.27 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.284 -1.127 . . . . 0.0 109.917 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.6 m -100.14 138.73 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.935 ' HB2' HG22 ' A' ' 12' ' ' THR . 12.2 t -58.18 118.79 5.85 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.256 -0.902 . . . . 0.0 110.478 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.2 m -64.11 -12.75 42.36 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.245 -0.909 . . . . 0.0 110.153 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -105.04 -25.46 12.53 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.183 -0.948 . . . . 0.0 110.855 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.567 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 7.5 p -147.9 28.05 0.95 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.657 -1.277 . . . . 0.0 111.12 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 30.69 40.56 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.688 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 178.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.935 HG22 ' HB2' ' A' ' 7' ' ' CYS . 12.2 t -90.44 139.7 30.43 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.976 -1.077 . . . . 0.0 108.96 178.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -99.0 -24.97 14.72 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.946 -1.096 . . . . 0.0 109.493 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.8 p -101.25 116.06 31.93 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.494 -0.754 . . . . 0.0 109.232 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.425 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 6.2 p -138.49 154.93 48.82 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.028 -1.045 . . . . 0.0 110.037 -179.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.492 HG22 ' CG2' ' A' ' 51' ' ' ILE . 40.9 p -74.87 -31.33 61.59 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.519 ' HA ' HD23 ' A' ' 17' ' ' LEU . 8.8 mt -153.94 125.01 7.32 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -82.04 106.51 14.01 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.628 -0.67 . . . . 0.0 109.979 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.546 ' HB2' ' O ' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -80.91 77.45 7.79 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.071 -1.018 . . . . 0.0 108.985 179.43 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 18.3 tpt180 -61.29 99.62 0.11 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.559 ' HB3' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -60.21 152.03 64.61 Favored Pre-proline 0 N--CA 1.5 2.026 0 O-C-N 121.395 -0.816 . . . . 0.0 109.545 -179.421 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -54.17 -44.21 51.4 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 C-N-CA 122.645 2.23 . . . . 0.0 110.809 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -19.08 64.95 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.255 -0.903 . . . . 0.0 109.731 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.02 41.63 1.16 Allowed Glycine 0 N--CA 1.496 2.678 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.559 ' HB2' ' HB3' ' A' ' 21' ' ' SER . 51.1 m-20 -120.02 96.25 49.32 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.274 -1.133 . . . . 0.0 110.196 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.503 ' CB ' HG23 ' A' ' 5' ' ' THR . 1.3 Cg_endo -68.22 96.44 0.47 Allowed 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.155 1.904 . . . . 0.0 109.838 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.546 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 2.0 m -111.45 122.71 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.064 -1.022 . . . . 0.0 110.549 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.425 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 4.2 p -45.51 129.87 8.63 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.5 -0.75 . . . . 0.0 110.125 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -32.35 -51.37 0.26 Allowed 'General case' 0 N--CA 1.507 2.424 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.54 -47.85 27.84 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.313 -0.867 . . . . 0.0 111.128 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 14.8 m -60.05 -45.79 91.67 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.381 -0.824 . . . . 0.0 108.87 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.85 -50.17 70.59 Favored Glycine 0 N--CA 1.493 2.463 0 N-CA-C 110.229 -1.148 . . . . 0.0 110.229 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 90.7 mt -63.9 -62.11 1.85 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.369 -1.077 . . . . 0.0 110.359 -179.448 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.556 ' CD1' ' HB2' ' A' ' 42' ' ' ARG . 21.0 t80 -51.67 -44.15 62.96 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.317 -0.864 . . . . 0.0 109.177 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.475 ' O ' ' N ' ' A' ' 39' ' ' GLN . 23.4 t80 -50.81 -48.48 59.72 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.573 -0.705 . . . . 0.0 109.41 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.22 -37.98 88.98 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.043 -1.035 . . . . 0.0 110.657 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 34' ' ' TYR . 7.5 mp -46.19 -53.97 9.56 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.05 -1.031 . . . . 0.0 110.008 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.524 ' CB ' HG22 ' A' ' 40' ' ' VAL . 88.1 m-70 -112.05 10.15 20.38 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.268 -0.895 . . . . 0.0 109.73 179.045 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.475 ' N ' ' O ' ' A' ' 35' ' ' TYR . 2.5 tt0 47.62 35.12 4.1 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.4 -0.813 . . . . 0.0 110.136 -178.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.524 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.7 m -132.94 -177.9 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 O-C-N 121.517 -0.74 . . . . 0.0 109.385 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -75.59 179.47 5.32 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.278 -0.889 . . . . 0.0 110.661 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.556 ' HB2' ' CD1' ' A' ' 34' ' ' TYR . 10.0 ttp180 -150.19 132.62 8.08 Favored Pre-proline 0 N--CA 1.498 1.957 0 O-C-N 121.198 -0.939 . . . . 0.0 109.787 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.421 ' HD2' ' HG2' ' A' ' 42' ' ' ARG . 1.2 Cg_endo -63.79 149.36 90.92 Favored 'Trans proline' 0 C--N 1.316 -1.154 0 C-N-CA 122.155 1.904 . . . . 0.0 110.657 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.567 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 1.1 pp -85.98 -1.47 57.36 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.02 -1.05 . . . . 0.0 110.245 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 t -61.3 -11.39 9.61 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.119 -0.988 . . . . 0.0 110.856 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.19 -7.36 48.54 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.782 -1.198 . . . . 0.0 110.694 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.595 ' HD3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -74.18 172.92 10.89 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.556 -1.34 . . . . 0.0 110.253 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.403 ' HG3' ' N ' ' A' ' 49' ' ' ASP . 1.9 tppp? -136.61 163.98 29.29 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.25 -0.906 . . . . 0.0 109.3 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.403 ' N ' ' HG3' ' A' ' 48' ' ' LYS . 6.4 t70 -49.09 -80.46 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.478 -0.764 . . . . 0.0 110.351 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.85 161.96 26.1 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.492 ' CG2' HG22 ' A' ' 16' ' ' THR . 5.4 mt -57.06 126.58 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.291 -1.123 . . . . 0.0 109.737 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -69.15 154.23 42.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.498 -0.751 . . . . 0.0 109.58 179.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.19 162.41 40.19 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.166 -0.959 . . . . 0.0 109.515 179.016 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.405 ' HD2' ' HA ' ' A' ' 54' ' ' ARG . 5.6 mmm180 -150.88 -172.61 4.25 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.54 -0.725 . . . . 0.0 110.421 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.19 79.53 0.97 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.13 -0.981 . . . . 0.0 109.562 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -58.58 162.2 4.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.604 -0.685 . . . . 0.0 110.41 -179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.8 pttt . . . . . 0 N--CA 1.498 1.971 0 O-C-N 121.442 -0.786 . . . . 0.0 109.919 179.353 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.798 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.484 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 130.38 -26.67 4.1 Favored Glycine 0 N--CA 1.495 2.624 0 N-CA-C 109.275 -1.53 . . . . 0.0 109.275 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.541 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 98.5 m -59.46 91.7 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.277 -1.131 . . . . 0.0 109.349 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 6' ' ' VAL . 21.0 m -83.91 111.0 19.26 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.049 -1.032 . . . . 0.0 108.261 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.487 ' CB ' HG22 ' A' ' 12' ' ' THR . 40.8 t -48.24 109.5 0.24 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.438 -0.789 . . . . 0.0 110.158 -178.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.6 m -58.29 -12.15 3.42 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.43 -0.794 . . . . 0.0 111.368 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.477 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.9 OUTLIER -96.16 -30.67 13.38 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.965 -1.084 . . . . 0.0 110.793 -179.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.594 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 17.4 p -141.03 19.3 2.28 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.661 -1.274 . . . . 0.0 111.41 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 47.5 25.61 0.66 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.321 -0.862 . . . . 0.0 111.768 179.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.487 HG22 ' CB ' ' A' ' 7' ' ' CYS . 8.1 t -87.49 132.96 33.84 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.81 -1.181 . . . . 0.0 109.816 179.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 94.8 p -90.24 -23.15 21.32 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.3 p -98.99 130.91 45.36 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.61 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 12.9 p -148.82 138.44 21.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.271 -0.893 . . . . 0.0 109.646 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.565 HG23 ' CG2' ' A' ' 51' ' ' ILE . 2.5 p -64.15 -34.87 79.05 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.61 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 46.7 mt -144.48 104.78 4.1 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 121.401 0.62 . . . . 0.0 109.5 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.61 ' CZ3' HG21 ' A' ' 15' ' ' THR . 6.5 m95 -62.56 99.93 0.17 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.191 -0.943 . . . . 0.0 109.85 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -83.94 82.08 8.5 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.395 -0.815 . . . . 0.0 108.954 179.568 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.443 ' NH1' ' HG3' ' A' ' 26' ' ' PRO . 4.1 tpp180 -63.06 96.14 0.09 Allowed 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -58.81 133.6 86.64 Favored Pre-proline 0 N--CA 1.495 1.798 0 O-C-N 121.385 -0.822 . . . . 0.0 110.289 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -56.4 -33.08 91.0 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 C-N-CA 122.517 2.145 . . . . 0.0 110.556 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -23.91 31.58 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.386 -0.821 . . . . 0.0 109.767 178.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.49 26.95 3.24 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -132.63 112.39 13.86 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 120.959 -1.318 . . . . 0.0 110.408 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.541 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 1.1 Cg_endo -67.95 105.95 1.24 Allowed 'Trans proline' 0 C--N 1.313 -1.321 0 C-N-CA 122.09 1.86 . . . . 0.0 109.474 178.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.478 ' O ' ' HB3' ' A' ' 19' ' ' ARG . 2.1 m -121.56 127.27 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.086 -1.009 . . . . 0.0 110.246 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.494 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.4 p -48.98 132.28 18.71 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.457 -0.777 . . . . 0.0 109.09 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.61 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.8 t-20 -35.7 -48.09 0.52 Allowed 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.685 -0.634 . . . . 0.0 111.761 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -45.42 -51.67 11.1 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.346 -0.847 . . . . 0.0 110.9 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 32.8 m -61.28 -47.99 83.44 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.395 -0.816 . . . . 0.0 109.243 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.07 -33.56 75.06 Favored Glycine 0 N--CA 1.497 2.75 0 N-CA-C 110.841 -0.903 . . . . 0.0 110.841 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 68.0 mt -74.16 -62.45 1.51 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.252 -1.146 . . . . 0.0 110.19 -179.294 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.634 ' HA ' HD22 ' A' ' 37' ' ' LEU . 25.0 t80 -55.52 -40.66 72.07 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.102 -0.999 . . . . 0.0 108.917 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.467 ' O ' ' N ' ' A' ' 39' ' ' GLN . 40.9 t80 -54.89 -46.13 74.77 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 0.0 109.675 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -61.36 -32.85 72.76 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.761 -1.212 . . . . 0.0 110.3 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.634 HD22 ' HA ' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -57.95 -62.13 2.03 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.214 -0.928 . . . . 0.0 110.863 -179.338 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.499 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 47.0 m-70 -105.0 9.8 34.34 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.011 -1.056 . . . . 0.0 110.364 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.3 OUTLIER 50.05 27.47 2.51 Favored 'General case' 0 N--CA 1.505 2.303 0 CA-C-O 121.589 0.709 . . . . 0.0 110.685 -179.117 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' CB ' ' A' ' 38' ' ' HIS . 6.2 m -130.94 160.95 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 O-C-N 121.237 -0.914 . . . . 0.0 110.19 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -79.87 162.49 24.99 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.371 0.605 . . . . 0.0 110.101 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.487 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -145.98 150.49 42.51 Favored Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.298 -0.876 . . . . 0.0 109.954 179.509 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -59.11 146.77 93.27 Favored 'Trans proline' 0 C--N 1.315 -1.213 0 C-N-CA 122.534 2.156 . . . . 0.0 111.031 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.594 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -83.93 37.21 0.59 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.297 -0.877 . . . . 0.0 110.865 -179.866 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.0 p -68.14 -8.38 38.02 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.007 -1.058 . . . . 0.0 110.293 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.3 mmm -93.0 -20.26 20.76 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.11 -0.994 . . . . 0.0 110.304 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.548 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -66.77 142.68 57.29 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.88 -1.137 . . . . 0.0 109.614 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -131.59 -155.42 0.69 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.35 -0.844 . . . . 0.0 109.53 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.15 -84.85 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.453 -0.779 . . . . 0.0 110.644 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -110.52 170.45 14.02 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.281 -1.527 . . . . 0.0 109.281 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.565 ' CG2' HG23 ' A' ' 16' ' ' THR . 5.3 mt -52.6 130.15 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.259 -1.142 . . . . 0.0 110.256 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.48 165.69 24.78 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.496 0.665 . . . . 0.0 109.545 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.88 166.52 29.29 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.292 -0.88 . . . . 0.0 109.287 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.67 -168.05 3.0 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.509 -0.744 . . . . 0.0 109.749 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.72 113.02 11.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.103 -0.998 . . . . 0.0 108.835 179.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.453 ' HG3' ' N ' ' A' ' 57' ' ' LYS . 2.7 ttp180 -51.43 151.69 2.94 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.451 -0.781 . . . . 0.0 109.964 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . 0.453 ' N ' ' HG3' ' A' ' 56' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.493 1.683 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.798 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 101.07 -46.66 1.28 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 108.635 -1.786 . . . . 0.0 108.635 -178.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.476 HG22 ' CH2' ' A' ' 18' ' ' TRP . 53.1 m -83.13 93.38 7.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.137 -1.213 . . . . 0.0 108.844 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.6 m -98.21 121.13 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.521 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 46.5 t -50.22 113.56 0.9 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.374 -0.829 . . . . 0.0 110.151 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.6 m -62.95 -11.84 21.44 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.139 -0.976 . . . . 0.0 111.112 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.478 ' OD1' HG11 ' A' ' 27' ' ' VAL . 6.5 m-20 -95.53 -31.68 13.21 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.911 -1.118 . . . . 0.0 110.747 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.517 ' SG ' HG22 ' A' ' 12' ' ' THR . 16.4 p -139.5 18.33 2.55 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.781 -1.199 . . . . 0.0 110.946 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.441 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 48.18 24.93 0.73 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.269 -0.894 . . . . 0.0 112.246 178.815 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.517 HG22 ' SG ' ' A' ' 10' ' ' CYS . 14.6 t -87.35 135.18 33.42 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.602 -1.312 . . . . 0.0 110.061 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.4 p -90.13 -16.14 30.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.487 -0.758 . . . . 0.0 109.145 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 44.9 p -102.92 129.56 49.68 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.289 -0.882 . . . . 0.0 108.713 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.564 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 7.0 p -146.36 148.76 32.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.204 -0.935 . . . . 0.0 110.092 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 32.8 p -72.03 -37.25 69.78 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 179.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.487 ' HA ' HD23 ' A' ' 17' ' ' LEU . 10.3 mt -147.07 105.55 3.8 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.564 ' CZ3' HG21 ' A' ' 15' ' ' THR . 11.4 m95 -59.51 98.62 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.466 -0.771 . . . . 0.0 110.306 -179.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.67 75.91 3.34 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.326 -0.859 . . . . 0.0 108.784 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.415 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.08 94.75 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.4 139.97 96.52 Favored Pre-proline 0 N--CA 1.499 1.992 0 O-C-N 121.44 -0.788 . . . . 0.0 110.429 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -53.98 -39.15 86.18 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 C-N-CA 122.832 2.355 . . . . 0.0 111.184 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -22.43 48.44 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.273 -0.892 . . . . 0.0 109.69 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.77 32.81 2.57 Favored Glycine 0 N--CA 1.498 2.77 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -128.04 98.13 27.79 Favored Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.167 -1.196 . . . . 0.0 110.076 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.521 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.1 Cg_endo -65.08 112.88 2.18 Favored 'Trans proline' 0 C--N 1.312 -1.381 0 C-N-CA 122.26 1.973 . . . . 0.0 110.191 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.478 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.2 m -124.28 131.2 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.151 -0.968 . . . . 0.0 109.953 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.497 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 6.1 p -53.67 134.73 41.62 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.43 0.633 . . . . 0.0 109.763 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -36.87 -44.73 0.51 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.724 -0.61 . . . . 0.0 112.075 -178.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.79 -47.81 59.64 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.331 -0.855 . . . . 0.0 110.187 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 55.9 m -68.36 -39.51 81.79 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.143 -0.973 . . . . 0.0 109.116 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.07 -36.91 69.25 Favored Glycine 0 N--CA 1.497 2.751 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 61.8 mt -80.17 -58.29 3.22 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.312 -1.11 . . . . 0.0 110.107 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.579 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 23.6 t80 -51.61 -36.69 46.75 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.541 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 17.9 t80 -59.79 -51.7 68.61 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.312 -0.867 . . . . 0.0 109.56 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -52.75 -26.15 13.3 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.664 -1.273 . . . . 0.0 110.353 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.4 mp -72.45 -66.33 0.67 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.961 -1.087 . . . . 0.0 110.381 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.45 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 77.5 m-70 -94.6 -26.57 16.31 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.992 -1.067 . . . . 0.0 110.797 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.541 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 75.56 25.53 1.21 Allowed 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 121.588 0.709 . . . . 0.0 111.374 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -124.63 167.02 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 120.941 -1.099 . . . . 0.0 110.431 179.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.6 p-10 -85.66 131.13 34.4 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.333 -0.854 . . . . 0.0 109.417 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.579 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 25.3 mmt180 -109.16 149.13 39.29 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.088 -1.008 . . . . 0.0 110.325 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.07 150.9 84.78 Favored 'Trans proline' 0 C--N 1.314 -1.263 0 C-N-CA 122.372 2.048 . . . . 0.0 110.431 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.617 HD13 ' CZ ' ' A' ' 47' ' ' ARG . 0.7 OUTLIER -74.33 29.83 0.08 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.187 -0.946 . . . . 0.0 111.231 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.7 p -67.97 -17.97 64.59 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.458 -1.401 . . . . 0.0 109.483 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.52 2.73 52.71 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.392 -0.818 . . . . 0.0 109.929 179.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.617 ' CZ ' HD13 ' A' ' 44' ' ' LEU . 3.0 ttp180 -67.39 173.11 4.24 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.897 -1.127 . . . . 0.0 109.51 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.76 164.85 37.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.165 -0.96 . . . . 0.0 109.773 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -44.43 -70.25 0.11 Allowed 'General case' 0 N--CA 1.504 2.236 0 CA-C-O 121.419 0.628 . . . . 0.0 109.626 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -121.38 175.16 16.12 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 108.632 -1.787 . . . . 0.0 108.632 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.524 HD11 ' O ' ' A' ' 15' ' ' THR . 4.8 mt -51.39 124.73 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.277 -1.131 . . . . 0.0 109.706 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.404 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -70.27 160.63 31.84 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.306 -0.871 . . . . 0.0 108.654 179.238 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.404 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.95 165.54 36.16 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.085 -1.01 . . . . 0.0 108.996 179.478 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -143.55 -178.33 5.84 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.213 -0.929 . . . . 0.0 109.523 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -52.15 123.67 11.18 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.31 -0.869 . . . . 0.0 108.722 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -48.41 113.48 0.76 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.61 -0.682 . . . . 0.0 109.43 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 24.2 ttpt . . . . . 0 N--CA 1.496 1.871 0 O-C-N 121.572 -0.705 . . . . 0.0 109.201 -179.622 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 115.23 -24.35 10.67 Favored Glycine 0 N--CA 1.496 2.687 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 -179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.495 HG23 ' HB2' ' A' ' 26' ' ' PRO . 30.7 m -71.96 92.38 1.27 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.873 -1.369 . . . . 0.0 109.309 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.6 m -93.54 117.03 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.51 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 44.7 t -45.51 112.37 0.45 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.446 -0.784 . . . . 0.0 110.409 -178.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 39.4 m -62.5 -8.94 7.09 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.429 -0.795 . . . . 0.0 111.305 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -104.96 -26.69 12.07 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.797 -1.189 . . . . 0.0 111.199 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.603 ' HA ' ' HB3' ' A' ' 44' ' ' LEU . 13.1 p -139.67 17.14 2.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.693 -1.254 . . . . 0.0 111.334 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 49.55 22.13 0.71 Allowed 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.237 -0.914 . . . . 0.0 111.995 178.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.537 ' HB ' ' SG ' ' A' ' 10' ' ' CYS . 2.0 t -90.04 125.48 35.42 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.799 -1.188 . . . . 0.0 109.473 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.4 p -88.95 -21.66 23.46 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.377 -0.827 . . . . 0.0 109.38 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.4 p -89.52 117.21 28.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.359 -0.838 . . . . 0.0 109.001 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.63 HG21 ' CH2' ' A' ' 18' ' ' TRP . 6.3 p -144.86 147.51 32.9 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.923 -1.111 . . . . 0.0 110.475 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 77.0 p -80.05 -30.37 39.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.541 -0.724 . . . . 0.0 109.08 179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.665 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -144.45 112.02 6.12 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.184 -0.947 . . . . 0.0 109.312 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.63 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.5 m95 -74.67 90.9 2.32 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.107 -0.995 . . . . 0.0 109.749 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.15 83.08 3.64 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.384 -0.822 . . . . 0.0 109.377 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.461 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.6 mmt180 -66.41 110.05 2.96 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.151 -0.968 . . . . 0.0 109.348 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 83.1 p -71.03 149.24 94.74 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.212 -0.93 . . . . 0.0 109.465 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -56.11 -22.34 39.24 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 122.432 2.088 . . . . 0.0 111.229 -179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -75.23 -3.43 33.12 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.196 -0.94 . . . . 0.0 110.169 179.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.9 34.41 9.0 Favored Glycine 0 N--CA 1.495 2.597 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -127.47 101.4 24.53 Favored Pre-proline 0 N--CA 1.494 1.741 0 O-C-N 121.458 -1.025 . . . . 0.0 110.43 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.51 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.3 Cg_endo -65.37 105.02 0.68 Allowed 'Trans proline' 0 C--N 1.315 -1.22 0 C-N-CA 122.593 2.195 . . . . 0.0 110.099 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.499 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.74 124.98 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.131 -0.981 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.489 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.0 p -49.19 131.2 19.7 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.459 0.647 . . . . 0.0 110.074 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.665 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 23.5 t-20 -37.18 -48.84 0.87 Allowed 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.629 -0.669 . . . . 0.0 111.548 -178.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -45.04 -44.08 9.86 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.425 -0.797 . . . . 0.0 110.296 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.525 ' HB3' ' HD3' ' A' ' 42' ' ' ARG . 3.4 m -64.03 -44.79 91.46 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.29 -33.24 85.46 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.496 ' O ' HD13 ' A' ' 37' ' ' LEU . 41.6 mt -76.33 -60.45 2.33 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.471 -1.017 . . . . 0.0 109.617 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.833 ' HA ' HD22 ' A' ' 37' ' ' LEU . 51.3 t80 -48.05 -38.88 18.39 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.303 -0.873 . . . . 0.0 109.289 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.495 ' CD2' ' O ' ' A' ' 40' ' ' VAL . 58.3 t80 -54.24 -53.9 47.37 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.439 -0.788 . . . . 0.0 109.602 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.04 -38.11 89.89 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.113 -0.992 . . . . 0.0 110.459 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.833 HD22 ' HA ' ' A' ' 34' ' ' TYR . 4.1 mp -42.77 -57.5 2.74 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.437 -0.79 . . . . 0.0 110.353 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.685 ' HB2' HG22 ' A' ' 40' ' ' VAL . 33.0 m-70 -118.3 13.69 13.7 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.286 -0.884 . . . . 0.0 109.705 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.47 ' N ' ' O ' ' A' ' 35' ' ' TYR . 17.6 tt0 45.76 47.33 11.9 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 121.842 0.83 . . . . 0.0 109.788 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.685 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.1 m -130.86 -170.82 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 121.545 -0.722 . . . . 0.0 109.71 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -61.69 -173.62 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.267 -0.896 . . . . 0.0 110.177 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.525 ' HD3' ' HB3' ' A' ' 31' ' ' CYS . 29.7 mtt180 -130.0 93.55 33.5 Favored Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 121.1 -1.0 . . . . 0.0 109.976 -179.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.561 ' HD2' ' CE1' ' A' ' 34' ' ' TYR . 5.0 Cg_exo -58.75 126.63 21.78 Favored 'Trans proline' 0 C--N 1.318 -1.061 0 C-N-CA 122.559 2.173 . . . . 0.0 110.866 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.603 ' HB3' ' HA ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -96.88 17.32 17.03 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.45 -0.781 . . . . 0.0 110.586 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.2 p -74.16 -4.57 36.6 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.996 -1.065 . . . . 0.0 110.198 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 1.0 OUTLIER -103.91 -0.66 28.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.082 -1.011 . . . . 0.0 110.626 179.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 9.4 mmm180 -51.13 141.36 14.44 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.628 -1.295 . . . . 0.0 110.215 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmm -119.38 -163.99 1.02 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.514 -0.741 . . . . 0.0 109.52 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -79.51 -89.35 0.06 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.209 -0.932 . . . . 0.0 110.175 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -96.11 165.91 24.34 Favored Glycine 0 N--CA 1.499 2.864 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.405 HD11 ' C ' ' A' ' 15' ' ' THR . 5.4 mt -54.3 129.06 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.246 -1.15 . . . . 0.0 109.767 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -70.33 141.91 52.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.297 -0.877 . . . . 0.0 109.275 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.72 158.13 40.54 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.946 -1.097 . . . . 0.0 110.159 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.471 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 1.1 mtm-85 -153.16 -158.47 0.89 Allowed 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -58.37 106.11 0.35 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.04 139.29 4.54 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.521 0.677 . . . . 0.0 110.94 -178.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.822 0 O-C-N 121.581 -0.699 . . . . 0.0 109.949 179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.88 0 N-CA-C 109.42 -0.585 . . . . 0.0 109.42 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.474 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 94.35 -37.13 3.49 Favored Glycine 0 N--CA 1.497 2.759 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.4 m -60.61 96.37 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.273 -1.134 . . . . 0.0 109.231 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.474 HG13 ' O ' ' A' ' 4' ' ' GLY . 20.8 m -96.94 138.72 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.532 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 22.1 t -59.88 122.67 14.82 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.425 -0.797 . . . . 0.0 110.835 -178.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -65.45 -16.04 63.24 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.193 -0.942 . . . . 0.0 109.965 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.519 ' ND2' HG11 ' A' ' 27' ' ' VAL . 34.0 m-20 -104.11 -19.17 14.26 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.031 -1.043 . . . . 0.0 111.209 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.517 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 9.0 p -154.0 26.28 0.48 Allowed 'General case' 0 N--CA 1.502 2.154 0 O-C-N 120.63 -1.294 . . . . 0.0 111.151 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.658 ' OE1' HD13 ' A' ' 44' ' ' LEU . 1.0 OUTLIER 31.15 37.11 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.642 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 178.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.591 HG23 HG22 ' A' ' 15' ' ' THR . 5.5 t -90.39 131.85 35.93 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.565 -1.335 . . . . 0.0 108.794 178.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 91.6 p -89.39 -26.37 21.06 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.447 -0.783 . . . . 0.0 109.426 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.5 p -99.51 113.3 25.6 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.485 -0.76 . . . . 0.0 109.124 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.591 HG22 HG23 ' A' ' 12' ' ' THR . 6.8 p -132.96 164.29 27.29 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.31 -0.869 . . . . 0.0 110.197 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 11.5 p -74.85 -45.95 39.67 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.517 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.415 ' HA ' HD23 ' A' ' 17' ' ' LEU . 12.8 mt -147.57 116.49 6.8 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -64.96 98.92 0.31 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.475 -0.765 . . . . 0.0 110.112 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.88 75.38 6.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.514 -0.741 . . . . 0.0 109.62 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.9 tpp180 -64.2 95.59 0.13 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.277 -0.889 . . . . 0.0 108.976 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.14 147.13 47.38 Favored Pre-proline 0 N--CA 1.499 2.017 0 O-C-N 121.437 -0.789 . . . . 0.0 110.133 -179.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -56.16 -33.66 91.01 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.383 2.055 . . . . 0.0 110.696 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.8 mtm -60.32 -23.15 63.98 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.214 -0.929 . . . . 0.0 109.537 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.89 45.64 1.01 Allowed Glycine 0 N--CA 1.497 2.733 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -134.84 104.26 10.77 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.468 -1.019 . . . . 0.0 110.277 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.508 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 Cg_endo -66.13 87.59 0.25 Allowed 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 122.317 2.011 . . . . 0.0 109.639 178.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.532 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -109.53 124.48 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.111 -0.993 . . . . 0.0 110.371 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.553 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.5 p -46.25 134.28 8.82 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.744 -0.597 . . . . 0.0 109.591 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.419 ' C ' ' O ' ' A' ' 28' ' ' CYS . 2.2 t-20 -34.74 -46.29 0.29 Allowed 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.747 -0.595 . . . . 0.0 111.46 -179.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.418 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -47.66 -51.81 20.33 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.509 -0.745 . . . . 0.0 111.27 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.533 ' HA ' ' HD3' ' A' ' 42' ' ' ARG . 52.0 m -62.35 -40.86 97.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.148 -0.97 . . . . 0.0 109.885 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.11 -35.69 91.86 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.446 HD23 ' HA ' ' A' ' 33' ' ' LEU . 83.6 mt -73.69 -62.19 1.58 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.294 -1.121 . . . . 0.0 109.717 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.475 ' CE1' ' HB3' ' A' ' 42' ' ' ARG . 32.1 t80 -51.71 -38.36 54.86 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.547 ' O ' ' N ' ' A' ' 39' ' ' GLN . 32.1 t80 -64.28 -43.72 93.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.465 -0.772 . . . . 0.0 110.118 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HD2' ' CD1' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -60.44 -21.92 62.84 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 119.988 -1.695 . . . . 0.0 110.059 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.54 ' CD1' ' HD2' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -84.74 -59.18 2.43 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.074 -1.016 . . . . 0.0 110.087 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -93.03 -28.48 16.36 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.21 -0.931 . . . . 0.0 109.695 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 35' ' ' TYR . 4.7 tt0 61.86 47.8 5.8 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 122.262 1.029 . . . . 0.0 109.999 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -141.17 168.56 15.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -71.4 125.75 27.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.788 -1.195 . . . . 0.0 108.429 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.533 ' HD3' ' HA ' ' A' ' 31' ' ' CYS . 1.8 ptm180 -95.5 146.99 32.3 Favored Pre-proline 0 N--CA 1.493 1.706 0 O-C-N 121.229 -0.919 . . . . 0.0 109.496 -178.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.572 ' HB2' HG22 ' A' ' 45' ' ' THR . 1.8 Cg_endo -62.71 133.53 42.66 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 C-N-CA 122.196 1.93 . . . . 0.0 110.565 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.658 HD13 ' OE1' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -76.51 -6.93 53.95 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.468 -0.77 . . . . 0.0 110.375 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.572 HG22 ' HB2' ' A' ' 43' ' ' PRO . 14.6 t -60.66 -28.09 68.31 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.12 -0.987 . . . . 0.0 110.798 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -77.54 -21.44 52.6 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.916 -1.115 . . . . 0.0 110.178 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.57 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -76.08 149.72 37.41 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.022 -1.049 . . . . 0.0 108.997 179.417 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.407 ' N ' ' HG2' ' A' ' 47' ' ' ARG . 34.8 mttm -124.84 -166.07 1.48 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.016 -1.052 . . . . 0.0 110.013 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -91.69 -45.56 8.38 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.072 -1.017 . . . . 0.0 109.9 -179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -95.08 135.46 12.42 Favored Glycine 0 N--CA 1.499 2.873 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.8 mt -50.62 120.97 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.164 -1.197 . . . . 0.0 109.802 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -63.39 151.14 41.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.632 -0.667 . . . . 0.0 109.895 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.451 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -156.32 154.98 31.46 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.977 -1.077 . . . . 0.0 109.366 178.853 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 53' ' ' THR . 5.9 mtp180 -150.89 -161.87 1.43 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -53.25 130.73 35.67 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.928 -1.107 . . . . 0.0 109.136 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 20.3 mtt180 -76.14 160.43 29.75 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.418 -0.801 . . . . 0.0 110.125 -179.053 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.493 1.692 0 O-C-N 121.358 -0.839 . . . . 0.0 109.722 179.94 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 1.706 0 N-CA-C 109.284 -0.636 . . . . 0.0 109.284 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.51 -30.66 9.2 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 109.211 -1.555 . . . . 0.0 109.211 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.612 HG23 ' HB2' ' A' ' 26' ' ' PRO . 15.5 m -70.77 89.09 0.74 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -1.17 . . . . 0.0 109.627 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 6' ' ' VAL . 20.3 m -97.06 124.11 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 7.9 t -43.66 113.99 0.58 Allowed 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.395 -0.816 . . . . 0.0 111.269 -178.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.3 m -59.62 -10.65 3.75 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.106 -0.996 . . . . 0.0 111.178 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -110.4 -28.66 8.46 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.812 -1.18 . . . . 0.0 110.956 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.568 ' O ' ' HD3' ' A' ' 47' ' ' ARG . 2.4 p -138.32 21.97 2.77 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 120.877 -1.139 . . . . 0.0 110.159 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER 30.53 37.57 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 179.272 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 12' ' ' THR . 14.9 t -90.83 126.22 35.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.783 -1.198 . . . . 0.0 109.072 178.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 p -89.66 -15.01 33.6 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.51 -0.744 . . . . 0.0 109.699 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -102.7 99.77 9.76 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.287 -0.883 . . . . 0.0 109.386 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.463 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 6.5 p -122.6 163.05 20.71 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.175 -0.953 . . . . 0.0 110.292 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.555 HG22 HG21 ' A' ' 51' ' ' ILE . 81.9 p -94.11 -32.17 13.87 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.658 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 67.5 mt -142.75 87.23 1.98 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.317 -0.864 . . . . 0.0 109.263 179.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.463 ' CZ2' HG23 ' A' ' 15' ' ' THR . 13.1 m95 -54.54 109.27 0.48 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.077 -1.014 . . . . 0.0 110.162 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -101.66 130.23 47.98 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.348 -0.845 . . . . 0.0 109.018 179.658 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.9 mmt180 -97.27 109.62 22.34 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.248 -0.908 . . . . 0.0 108.875 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.74 146.5 98.49 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.177 -0.952 . . . . 0.0 109.392 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -58.1 -21.09 49.17 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 C-N-CA 122.2 1.934 . . . . 0.0 110.613 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 10.8 mtt -81.54 -0.96 44.43 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.317 -0.864 . . . . 0.0 109.788 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.89 35.43 7.73 Favored Glycine 0 N--CA 1.497 2.711 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -124.22 105.24 31.47 Favored Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.386 -1.067 . . . . 0.0 110.524 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.612 ' HB2' HG23 ' A' ' 5' ' ' THR . 1.5 Cg_endo -66.63 93.27 0.31 Allowed 'Trans proline' 0 C--N 1.314 -1.27 0 C-N-CA 122.235 1.957 . . . . 0.0 109.579 178.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.534 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -109.75 124.47 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 121.107 -0.996 . . . . 0.0 110.561 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.426 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.4 p -45.97 131.43 9.72 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.753 -0.592 . . . . 0.0 110.398 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.658 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 7.2 t-20 -36.63 -45.56 0.53 Allowed 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.708 -0.62 . . . . 0.0 111.934 -178.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.24 -49.05 34.77 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.563 -0.711 . . . . 0.0 109.93 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.618 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 8.9 m -59.65 -46.35 89.27 Favored 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -55.03 -54.6 32.83 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.525 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 96.0 mt -59.23 -57.62 12.24 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.644 -0.915 . . . . 0.0 109.594 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.417 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 30.6 t80 -43.8 -36.4 2.29 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.339 -0.851 . . . . 0.0 109.59 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.49 ' O ' ' N ' ' A' ' 39' ' ' GLN . 38.7 t80 -58.82 -52.81 64.12 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.333 -0.854 . . . . 0.0 109.722 178.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -65.65 -26.97 68.05 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.964 -1.085 . . . . 0.0 110.483 -179.945 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.494 HD13 ' O ' ' A' ' 33' ' ' LEU . 9.8 mp -53.53 -57.69 9.82 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.215 -0.928 . . . . 0.0 109.285 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.501 ' CB ' HG22 ' A' ' 40' ' ' VAL . 76.8 m-70 -113.79 11.65 18.07 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.18 -0.95 . . . . 0.0 109.771 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.49 ' N ' ' O ' ' A' ' 35' ' ' TYR . 4.9 tm0? 51.92 30.93 7.77 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.362 -0.836 . . . . 0.0 110.018 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.501 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.2 m -131.38 -171.29 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.35 -0.844 . . . . 0.0 109.516 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -66.72 -173.2 0.21 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.249 -0.907 . . . . 0.0 110.105 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.618 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -142.78 116.62 6.3 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.102 -0.999 . . . . 0.0 109.702 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -63.37 147.79 93.25 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 C-N-CA 122.069 1.846 . . . . 0.0 110.302 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.37 16.71 9.61 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.199 -0.938 . . . . 0.0 110.392 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.06 -12.95 60.21 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.054 -1.029 . . . . 0.0 109.858 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . 0.424 ' O ' ' HG3' ' A' ' 46' ' ' MET . 0.0 OUTLIER -89.36 -5.23 57.65 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.034 -1.041 . . . . 0.0 110.664 179.632 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.568 ' HD3' ' O ' ' A' ' 10' ' ' CYS . 65.6 mtm180 -57.27 165.25 1.48 Allowed 'General case' 0 N--CA 1.504 2.236 0 O-C-N 120.65 -1.281 . . . . 0.0 110.571 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.22 145.62 31.39 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.421 -0.799 . . . . 0.0 109.926 179.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -47.6 -36.57 10.96 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.636 -0.665 . . . . 0.0 110.01 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.0 146.84 18.76 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 108.48 -1.848 . . . . 0.0 108.48 179.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.555 HG21 HG22 ' A' ' 16' ' ' THR . 5.3 mt -46.73 114.79 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 121.474 -1.015 . . . . 0.0 110.016 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -51.55 142.32 14.37 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.579 -0.701 . . . . 0.0 109.497 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.36 159.09 39.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.96 -1.087 . . . . 0.0 110.054 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.57 -157.65 0.83 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.703 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -62.74 97.18 0.1 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 120.884 -1.135 . . . . 0.0 108.726 179.048 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . 0.439 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 0.2 OUTLIER -45.06 143.59 1.51 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.678 -0.639 . . . . 0.0 110.473 -179.114 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.497 1.887 0 O-C-N 121.397 -0.814 . . . . 0.0 110.086 -179.697 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.884 0 N-CA-C 109.589 -0.523 . . . . 0.0 109.589 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.32 -19.67 50.99 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.598 HG23 ' HB2' ' A' ' 26' ' ' PRO . 54.5 m -69.19 87.84 0.42 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.049 -1.266 . . . . 0.0 109.249 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 6' ' ' VAL . 34.6 m -78.8 110.12 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.5 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 41.0 t -47.44 109.44 0.22 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.262 -0.899 . . . . 0.0 110.391 -178.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 24.7 m -59.39 -12.49 6.03 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.326 -0.859 . . . . 0.0 111.628 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.7 ' OD1' HG11 ' A' ' 27' ' ' VAL . 2.1 m120 -95.61 -28.84 14.64 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.612 -1.305 . . . . 0.0 111.059 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.644 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 15.0 p -142.37 17.22 2.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.863 -1.148 . . . . 0.0 111.494 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 4.3 mp0 53.43 18.65 1.4 Allowed 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.2 -0.937 . . . . 0.0 112.052 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.575 HG22 ' SG ' ' A' ' 10' ' ' CYS . 14.5 t -84.15 128.72 34.74 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.401 -1.437 . . . . 0.0 109.786 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.2 p -89.72 -28.46 19.39 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.444 -0.785 . . . . 0.0 109.533 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.436 ' HB ' HG13 ' A' ' 51' ' ' ILE . 27.9 p -93.32 127.44 38.92 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.647 ' O ' HD11 ' A' ' 51' ' ' ILE . 4.8 p -146.44 145.49 30.25 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.034 -1.041 . . . . 0.0 110.097 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.472 HG22 HG23 ' A' ' 51' ' ' ILE . 25.1 p -68.0 -32.06 72.18 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 13.5 mt -149.03 122.6 9.15 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.332 -0.855 . . . . 0.0 109.57 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.565 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.8 m95 -80.89 109.13 15.17 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.302 -0.874 . . . . 0.0 110.255 -179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.09 78.69 4.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.39 -0.819 . . . . 0.0 108.904 179.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.8 122.9 15.99 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.216 -0.927 . . . . 0.0 109.872 -179.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.7 143.26 37.95 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.592 -0.693 . . . . 0.0 109.518 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -56.86 -38.82 94.98 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.496 2.13 . . . . 0.0 110.742 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.36 -23.73 50.83 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.405 -0.809 . . . . 0.0 109.586 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.78 39.06 1.63 Allowed Glycine 0 N--CA 1.496 2.658 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -133.18 97.15 16.73 Favored Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.397 -1.061 . . . . 0.0 110.177 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.598 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.9 Cg_endo -63.98 112.68 1.91 Allowed 'Trans proline' 0 C--N 1.312 -1.387 0 C-N-CA 122.091 1.861 . . . . 0.0 109.952 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.7 HG11 ' OD1' ' A' ' 9' ' ' ASN . 3.3 m -122.62 129.1 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.074 -1.017 . . . . 0.0 110.5 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.522 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.2 p -52.68 139.2 26.84 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 121.441 0.638 . . . . 0.0 110.559 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 19.7 t-20 -40.35 -47.78 2.58 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.88 -0.512 . . . . 0.0 112.071 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.43 -41.68 52.91 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.195 -0.941 . . . . 0.0 110.355 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.409 ' HB3' ' HD2' ' A' ' 42' ' ' ARG . 9.6 m -66.77 -36.81 83.29 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.156 -0.965 . . . . 0.0 108.526 178.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.81 -48.79 59.24 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.436 ' O ' HD13 ' A' ' 37' ' ' LEU . 93.8 mt -61.04 -59.44 5.36 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.583 -0.951 . . . . 0.0 109.619 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.487 ' CD1' ' HB3' ' A' ' 42' ' ' ARG . 18.4 t80 -47.97 -40.35 22.07 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.564 -0.71 . . . . 0.0 109.515 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.446 ' HB2' ' NH1' ' A' ' 42' ' ' ARG . 41.4 t80 -58.33 -49.9 75.53 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.313 -0.867 . . . . 0.0 109.62 179.209 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 tttt -61.14 -34.66 75.36 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.979 -1.076 . . . . 0.0 109.945 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.436 HD13 ' O ' ' A' ' 33' ' ' LEU . 9.1 mp -53.62 -63.27 1.2 Allowed 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.657 -0.652 . . . . 0.0 110.682 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.534 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 83.1 m-70 -105.93 12.58 30.44 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.121 -0.987 . . . . 0.0 110.39 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER 47.42 28.35 1.1 Allowed 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 121.614 0.721 . . . . 0.0 110.895 -179.327 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.497 HG22 ' CB ' ' A' ' 38' ' ' HIS . 8.2 m -130.96 -170.45 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 O-C-N 121.203 -0.936 . . . . 0.0 109.873 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -62.47 -177.27 0.13 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.497 -0.752 . . . . 0.0 109.853 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.487 ' HB3' ' CD1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -146.28 111.17 4.33 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 120.902 -1.124 . . . . 0.0 110.179 -179.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -60.15 134.04 53.56 Favored 'Trans proline' 0 C--N 1.316 -1.157 0 C-N-CA 122.115 1.877 . . . . 0.0 110.298 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.644 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 1.2 pp -88.8 9.93 22.83 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.303 -0.873 . . . . 0.0 110.835 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 43.7 p -70.36 -9.93 57.6 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.064 -1.022 . . . . 0.0 110.569 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 ttt -95.77 -22.05 17.75 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.94 -1.1 . . . . 0.0 110.531 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.467 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -67.27 152.02 46.47 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.829 -1.169 . . . . 0.0 110.055 -179.895 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.413 ' HB2' ' OE1' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -106.94 -160.52 0.74 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.379 -0.826 . . . . 0.0 109.716 179.836 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -47.67 -73.2 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.264 -0.897 . . . . 0.0 110.698 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -136.48 -158.52 8.09 Favored Glycine 0 N--CA 1.498 2.778 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.647 HD11 ' O ' ' A' ' 15' ' ' THR . 9.3 mt -50.91 111.15 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.223 -1.163 . . . . 0.0 110.033 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.413 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -78.16 156.45 29.87 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.423 -0.798 . . . . 0.0 109.213 179.612 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -154.99 163.05 40.85 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.137 -0.977 . . . . 0.0 109.718 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.85 -168.77 3.2 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.04 124.88 23.75 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.944 -1.097 . . . . 0.0 108.99 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.5 mtt180 -53.22 136.84 35.72 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.438 -0.789 . . . . 0.0 110.07 -179.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.494 1.729 0 O-C-N 121.538 -0.727 . . . . 0.0 109.799 179.673 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.828 0 N-CA-C 109.407 -0.59 . . . . 0.0 109.407 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.31 -22.57 32.5 Favored Glycine 0 N--CA 1.498 2.806 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 -179.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.402 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 26.4 m -66.9 99.87 0.67 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.121 -1.223 . . . . 0.0 109.717 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.8 m -97.82 104.32 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.577 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 42.3 t -40.72 106.88 0.06 Allowed 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.719 -0.613 . . . . 0.0 110.549 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.4 m -57.31 -17.22 11.16 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.554 -0.716 . . . . 0.0 111.595 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.499 ' OD1' HG11 ' A' ' 27' ' ' VAL . 5.3 m120 -95.43 -30.91 13.63 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.654 -1.278 . . . . 0.0 111.419 -179.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.493 ' SG ' ' HB ' ' A' ' 12' ' ' THR . 13.3 p -133.15 17.94 4.08 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.557 -1.34 . . . . 0.0 111.06 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 7' ' ' CYS . 26.4 mt-30 44.67 31.78 0.69 Allowed 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.318 -0.863 . . . . 0.0 112.108 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.498 HG22 ' CB ' ' A' ' 7' ' ' CYS . 3.2 t -90.61 127.38 36.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.655 -1.278 . . . . 0.0 109.376 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.21 -20.48 24.13 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.578 -0.701 . . . . 0.0 109.29 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.455 HG21 ' O ' ' A' ' 49' ' ' ASP . 18.7 p -106.79 133.86 50.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.209 -0.932 . . . . 0.0 109.021 179.184 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.552 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 8.0 p -146.06 156.59 43.57 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.219 -0.926 . . . . 0.0 110.502 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.59 HG22 HG21 ' A' ' 51' ' ' ILE . 43.4 p -87.02 -29.59 21.85 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.671 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 24.5 mt -146.33 91.01 2.0 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.282 -0.886 . . . . 0.0 109.289 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.552 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.8 m95 -54.7 102.67 0.07 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.947 -1.095 . . . . 0.0 109.545 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -101.13 95.22 6.41 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.454 -0.779 . . . . 0.0 110.128 -178.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.3 mmt180 -62.74 110.29 1.69 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.194 -0.942 . . . . 0.0 108.895 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.6 137.78 83.25 Favored Pre-proline 0 N--CA 1.496 1.862 0 O-C-N 121.195 -0.941 . . . . 0.0 110.182 -179.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -56.39 -29.59 77.92 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 C-N-CA 122.701 2.267 . . . . 0.0 110.832 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 18.9 ttm -54.88 -25.25 27.68 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.577 -0.702 . . . . 0.0 109.483 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.43 30.92 2.94 Favored Glycine 0 N--CA 1.497 2.726 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -140.27 124.34 10.7 Favored Pre-proline 0 N--CA 1.493 1.678 0 O-C-N 121.165 -1.197 . . . . 0.0 110.107 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.542 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.7 Cg_endo -65.94 104.16 0.67 Allowed 'Trans proline' 0 C--N 1.314 -1.275 0 C-N-CA 122.143 1.895 . . . . 0.0 109.805 179.293 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.577 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -117.3 127.27 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-O 122.156 0.979 . . . . 0.0 110.731 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.532 ' SG ' ' HB3' ' A' ' 30' ' ' ALA . 12.0 p -48.97 138.32 11.72 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.726 -0.609 . . . . 0.0 109.594 179.11 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.671 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 1.6 t-20 -44.68 -33.3 1.79 Allowed 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.519 -0.738 . . . . 0.0 110.779 -179.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.532 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -54.63 -48.44 72.26 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.088 -1.008 . . . . 0.0 109.584 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.461 ' SG ' ' HD3' ' A' ' 42' ' ' ARG . 26.8 m -64.18 -39.11 93.31 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.434 -0.791 . . . . 0.0 109.382 179.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.54 -28.65 72.09 Favored Glycine 0 N--CA 1.496 2.633 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.546 ' O ' ' HD3' ' A' ' 36' ' ' LYS . 42.5 mt -76.91 -70.1 0.48 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.319 -1.107 . . . . 0.0 110.387 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.524 ' HA ' HD13 ' A' ' 37' ' ' LEU . 7.7 t80 -43.83 -35.59 1.99 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.352 -0.843 . . . . 0.0 109.146 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.528 ' O ' ' HA ' ' A' ' 39' ' ' GLN . 28.6 t80 -58.55 -51.92 67.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.481 -0.762 . . . . 0.0 110.527 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.546 ' HD3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -59.59 -22.43 61.76 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.392 -1.442 . . . . 0.0 110.723 -179.534 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.524 HD13 ' HA ' ' A' ' 34' ' ' TYR . 1.9 mp -73.73 -69.32 0.44 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.41 -0.806 . . . . 0.0 110.249 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.549 ' HB2' HG22 ' A' ' 40' ' ' VAL . 35.5 m-70 -100.96 15.08 29.8 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.282 -0.886 . . . . 0.0 110.191 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.528 ' HA ' ' O ' ' A' ' 35' ' ' TYR . 4.4 pm0 36.86 43.88 0.32 Allowed 'General case' 0 N--CA 1.503 2.203 0 CA-C-O 121.547 0.689 . . . . 0.0 111.45 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.549 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.2 m -132.92 178.4 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 O-C-N 121.434 -0.792 . . . . 0.0 109.989 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -70.4 172.95 7.49 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.286 -0.883 . . . . 0.0 110.475 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.461 ' HD3' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -131.83 131.73 22.85 Favored Pre-proline 0 N--CA 1.501 2.123 0 O-C-N 121.306 -0.871 . . . . 0.0 109.226 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.574 ' HB2' HG22 ' A' ' 45' ' ' THR . 3.3 Cg_endo -68.44 146.56 68.77 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 122.492 2.128 . . . . 0.0 111.674 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.505 ' O ' ' HB3' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -92.93 -3.24 54.88 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.617 -0.677 . . . . 0.0 110.061 178.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.574 HG22 ' HB2' ' A' ' 43' ' ' PRO . 2.2 t -63.69 -35.78 81.67 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.914 -1.116 . . . . 0.0 110.281 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 5.4 ttt -84.38 8.56 15.79 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.99 -1.069 . . . . 0.0 110.076 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.505 ' HB3' ' O ' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -75.08 157.38 34.85 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.859 -1.15 . . . . 0.0 109.907 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -139.33 146.83 40.77 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.247 -0.908 . . . . 0.0 109.232 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . 0.455 ' O ' HG21 ' A' ' 14' ' ' THR . 0.5 OUTLIER -64.89 -39.15 93.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.859 . . . . 0.0 109.625 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -98.11 130.66 10.31 Favored Glycine 0 N--CA 1.495 2.632 0 N-CA-C 109.026 -1.629 . . . . 0.0 109.026 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.59 HG21 HG22 ' A' ' 16' ' ' THR . 5.3 mt -45.93 113.13 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.664 -0.904 . . . . 0.0 109.921 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -55.17 149.77 11.91 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.689 -0.632 . . . . 0.0 110.309 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.88 160.94 40.59 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.129 -0.982 . . . . 0.0 109.462 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -151.5 -161.64 1.37 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.655 -0.653 . . . . 0.0 109.858 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -55.99 133.66 51.85 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.074 -1.016 . . . . 0.0 108.949 179.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -61.32 158.99 13.17 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 121.607 0.718 . . . . 0.0 110.199 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.4 ttmt . . . . . 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 0.0 110.0 179.796 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.916 0 CA-C-O 121.101 0.477 . . . . 0.0 109.834 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 53.42 36.64 53.94 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.449 ' O ' ' CH2' ' A' ' 18' ' ' TRP . 25.2 m -55.45 94.54 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.553 -0.969 . . . . 0.0 109.857 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.4 m -89.95 112.31 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.587 ' HB3' HG22 ' A' ' 12' ' ' THR . 38.7 t -44.18 109.44 0.15 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.498 -0.751 . . . . 0.0 110.669 -178.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.7 m -57.73 -20.08 32.12 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.11 -0.994 . . . . 0.0 111.72 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.455 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 9.4 m-20 -85.67 -30.74 22.96 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.951 -1.093 . . . . 0.0 110.786 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.578 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 18.6 p -141.86 24.84 2.0 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.666 -1.271 . . . . 0.0 111.103 179.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.512 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 40.36 26.95 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.786 -0.571 . . . . 0.0 111.936 179.811 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.587 HG22 ' HB3' ' A' ' 7' ' ' CYS . 5.7 t -85.65 130.13 34.65 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.779 -1.201 . . . . 0.0 109.531 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -90.66 6.12 45.21 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.533 -0.73 . . . . 0.0 109.292 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.48 ' HB ' ' CG1' ' A' ' 51' ' ' ILE . 14.5 p -125.82 124.55 41.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.259 -0.901 . . . . 0.0 109.57 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.634 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 9.6 p -145.3 146.44 31.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.036 -1.04 . . . . 0.0 110.387 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.427 ' O ' ' HG ' ' A' ' 17' ' ' LEU . 22.5 p -67.04 -38.54 86.07 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 16' ' ' THR . 11.6 mt -149.86 107.61 3.68 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.634 ' CZ3' HG21 ' A' ' 15' ' ' THR . 40.9 m95 -59.27 94.83 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.515 -0.74 . . . . 0.0 110.262 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.04 87.67 5.42 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.371 -0.83 . . . . 0.0 108.951 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.11 102.8 0.32 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.402 -0.811 . . . . 0.0 109.43 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.1 t -67.59 136.98 93.02 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.351 -0.843 . . . . 0.0 110.169 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -58.98 -30.12 92.45 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 C-N-CA 122.625 2.217 . . . . 0.0 110.924 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -57.67 -24.91 59.15 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.223 -0.923 . . . . 0.0 109.281 179.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 113.2 33.9 1.89 Allowed Glycine 0 N--CA 1.496 2.666 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -136.77 109.27 9.25 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.21 -1.171 . . . . 0.0 110.596 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.535 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 5.8 Cg_exo -62.36 102.6 0.28 Allowed 'Trans proline' 0 C--N 1.315 -1.21 0 C-N-CA 122.155 1.903 . . . . 0.0 109.464 178.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.458 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -111.69 155.89 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 120.977 -1.077 . . . . 0.0 110.943 -179.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.507 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 15.3 p -82.32 139.58 34.06 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -38.04 -44.23 0.79 Allowed 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.762 -0.586 . . . . 0.0 111.413 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.28 -48.62 76.24 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.24 -0.912 . . . . 0.0 111.239 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 3.6 m -56.29 -49.78 73.29 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.265 -0.897 . . . . 0.0 108.663 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.09 -38.46 93.07 Favored Glycine 0 N--CA 1.494 2.554 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.411 HD23 ' HA ' ' A' ' 33' ' ' LEU . 44.8 mt -67.72 -67.75 0.44 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.492 -1.005 . . . . 0.0 110.13 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.403 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 89.4 t80 -52.74 -37.36 59.18 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.445 -0.785 . . . . 0.0 109.256 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' A' ' 39' ' ' GLN . 43.3 t80 -60.74 -45.65 93.46 Favored 'General case' 0 C--O 1.2 -1.523 0 O-C-N 121.414 -0.804 . . . . 0.0 108.917 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.39 -29.74 61.86 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.194 -1.566 . . . . 0.0 110.06 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 5.4 mp -64.74 -65.82 0.62 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.945 -1.097 . . . . 0.0 110.122 -179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -94.61 -32.73 13.28 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.228 -0.92 . . . . 0.0 109.977 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.575 ' N ' ' O ' ' A' ' 35' ' ' TYR . 21.7 tt0 72.87 46.09 0.27 Allowed 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 121.734 0.778 . . . . 0.0 110.577 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 m -140.34 167.69 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 121.395 -0.815 . . . . 0.0 109.219 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -85.16 129.88 34.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.065 -1.022 . . . . 0.0 109.036 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -130.17 146.38 61.31 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.188 -0.945 . . . . 0.0 109.882 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.0 144.31 99.48 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 C-N-CA 122.622 2.215 . . . . 0.0 111.314 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.722 HD12 ' HB2' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -78.89 48.01 0.8 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.121 -0.987 . . . . 0.0 110.739 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.5 t -66.31 -12.19 55.15 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.133 -0.98 . . . . 0.0 110.141 178.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -103.32 -2.28 27.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.988 -1.07 . . . . 0.0 110.565 179.489 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.722 ' HB2' HD12 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -67.1 157.93 32.4 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.631 -1.293 . . . . 0.0 110.256 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.0 mttt -143.51 -163.84 1.74 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.586 -0.696 . . . . 0.0 109.487 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.53 -74.01 0.3 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.211 -0.931 . . . . 0.0 110.015 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.45 161.74 26.44 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.48 ' CG1' ' HB ' ' A' ' 14' ' ' THR . 7.6 mt -55.32 135.43 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.238 -1.154 . . . . 0.0 110.096 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -69.87 150.02 47.24 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.363 -0.836 . . . . 0.0 109.248 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.63 160.85 40.76 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.112 -0.993 . . . . 0.0 109.763 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -151.21 175.96 11.67 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.799 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -63.49 93.05 0.07 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.8 ptt180 -47.55 130.22 13.86 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.662 -0.649 . . . . 0.0 110.503 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.499 2.022 0 O-C-N 121.688 -0.633 . . . . 0.0 110.069 -179.791 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.843 0 N-CA-C 109.403 -0.591 . . . . 0.0 109.403 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.46 -35.58 2.89 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.558 HG23 ' HB2' ' A' ' 26' ' ' PRO . 3.5 m -64.68 93.77 0.11 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.282 -1.128 . . . . 0.0 109.094 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.8 m -98.65 137.64 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.641 ' HB2' HG22 ' A' ' 12' ' ' THR . 9.4 t -56.16 117.61 3.92 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.47 -0.769 . . . . 0.0 110.659 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -58.52 -16.28 14.78 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.466 -0.771 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.496 ' OD1' ' HD3' ' A' ' 42' ' ' ARG . 4.5 m-80 -109.42 -24.96 10.77 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.923 -1.111 . . . . 0.0 111.569 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.465 ' HA ' ' HB3' ' A' ' 44' ' ' LEU . 4.8 p -140.23 19.82 2.42 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.491 -1.38 . . . . 0.0 111.466 179.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 39.24 34.81 0.13 Allowed 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.554 -0.716 . . . . 0.0 112.841 178.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.641 HG22 ' HB2' ' A' ' 7' ' ' CYS . 11.0 t -89.18 132.49 34.82 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.61 -1.306 . . . . 0.0 108.822 178.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.74 -25.11 18.34 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.471 -0.768 . . . . 0.0 110.191 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.527 ' HB ' HG13 ' A' ' 51' ' ' ILE . 68.9 p -103.88 114.8 29.32 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.167 -0.958 . . . . 0.0 109.209 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.2 p -130.4 161.55 31.1 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 119.664 -0.814 . . . . 0.0 110.594 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 6.4 p -82.8 -36.46 25.56 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.445 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 17.8 mt -143.05 106.09 4.54 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.55 ' CH2' HG22 ' A' ' 5' ' ' THR . 16.3 m95 -64.27 107.21 1.26 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.373 -0.829 . . . . 0.0 110.391 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.602 ' HB3' HG23 ' A' ' 27' ' ' VAL . 6.8 tpt180 -81.66 72.97 8.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 108.719 179.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 10.7 tpp180 -63.52 92.42 0.06 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.0 143.79 91.51 Favored Pre-proline 0 N--CA 1.499 1.979 0 O-C-N 121.338 -0.851 . . . . 0.0 110.354 -178.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -54.5 -42.56 66.94 Favored 'Trans proline' 0 C--N 1.32 -0.967 0 C-N-CA 122.632 2.221 . . . . 0.0 111.09 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -21.16 58.58 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.283 -0.886 . . . . 0.0 109.972 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.34 42.13 1.19 Allowed Glycine 0 N--CA 1.497 2.719 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -128.7 92.82 39.28 Favored Pre-proline 0 N--CA 1.493 1.687 0 O-C-N 121.373 -1.075 . . . . 0.0 110.091 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.3 Cg_endo -64.35 95.2 0.21 Allowed 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 122.51 2.14 . . . . 0.0 110.003 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.602 HG23 ' HB3' ' A' ' 19' ' ' ARG . 2.4 m -114.05 123.26 69.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.071 -1.018 . . . . 0.0 110.655 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.41 ' HB3' ' CG2' ' A' ' 12' ' ' THR . 6.5 p -45.63 132.62 8.36 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.27 -0.894 . . . . 0.0 109.947 179.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.445 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 6.4 t-20 -37.48 -42.45 0.52 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.61 -0.681 . . . . 0.0 111.825 -178.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.78 -46.29 50.58 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.24 -0.913 . . . . 0.0 110.217 179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.412 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 33.0 m -66.75 -33.61 76.02 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.327 -0.858 . . . . 0.0 109.352 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.01 -38.61 95.66 Favored Glycine 0 N--CA 1.493 2.468 0 N-CA-C 109.156 -1.577 . . . . 0.0 109.156 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.52 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 95.2 mt -73.09 -58.01 3.62 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.526 -0.985 . . . . 0.0 110.045 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.422 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 29.6 t80 -46.14 -37.34 6.82 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.198 -0.938 . . . . 0.0 109.559 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.508 ' O ' ' N ' ' A' ' 39' ' ' GLN . 18.5 t80 -60.7 -55.42 33.4 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.37 -0.831 . . . . 0.0 110.413 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -57.29 -24.1 52.74 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.575 -1.328 . . . . 0.0 110.802 -179.556 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.475 HD12 ' HG3' ' A' ' 36' ' ' LYS . 5.7 mp -65.3 -67.19 0.46 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.345 -0.847 . . . . 0.0 109.823 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.519 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 66.1 m-70 -97.16 -29.5 13.56 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.295 -0.878 . . . . 0.0 110.395 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.519 ' CG ' ' O ' ' A' ' 38' ' ' HIS . 0.1 OUTLIER 87.4 27.5 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.571 0 CA-C-O 121.609 0.719 . . . . 0.0 110.574 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 m -124.63 -171.0 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.078 -1.014 . . . . 0.0 109.629 179.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.17 175.64 0.21 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.058 -1.027 . . . . 0.0 109.378 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.496 ' HD3' ' OD1' ' A' ' 9' ' ' ASN . 1.6 mpt_? -119.8 132.86 23.9 Favored Pre-proline 0 N--CA 1.495 1.804 0 O-C-N 120.909 -1.119 . . . . 0.0 109.805 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -62.8 126.32 17.9 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 C-N-CA 122.39 2.06 . . . . 0.0 110.965 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.465 ' HB3' ' HA ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -94.16 -19.72 20.52 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.422 -0.799 . . . . 0.0 110.123 179.521 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.22 -34.33 70.3 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.218 -0.926 . . . . 0.0 110.423 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -74.74 -29.81 61.29 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.243 -0.911 . . . . 0.0 109.482 179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.505 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -64.16 141.75 58.66 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.365 -0.835 . . . . 0.0 109.34 179.795 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 tttt -104.42 178.27 4.61 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.282 -0.886 . . . . 0.0 110.15 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -74.94 -33.69 61.98 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.338 -0.852 . . . . 0.0 110.265 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -114.09 149.03 18.77 Favored Glycine 0 N--CA 1.497 2.757 0 N-CA-C 109.079 -1.609 . . . . 0.0 109.079 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.527 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.2 mt -46.35 107.77 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.545 -0.974 . . . . 0.0 110.128 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 7.1 mt-30 -52.3 147.59 7.67 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.393 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.34 161.75 40.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.49 -1.381 . . . . 0.0 109.984 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.46 -152.37 0.43 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -60.02 114.31 2.77 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.808 -1.182 . . . . 0.0 107.944 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -47.17 133.71 11.59 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.665 -0.647 . . . . 0.0 109.864 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp . . . . . 0 N--CA 1.498 1.937 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.451 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.496 1.836 0 N-CA-C 109.419 -0.586 . . . . 0.0 109.419 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.79 -30.38 9.84 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.442 HG22 ' CH2' ' A' ' 18' ' ' TRP . 92.7 m -72.61 89.1 1.29 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.188 -1.183 . . . . 0.0 109.579 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 6' ' ' VAL . 32.7 m -85.61 122.13 38.04 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 53.4 t -56.02 113.9 1.71 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.932 -1.105 . . . . 0.0 110.05 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -60.8 -12.96 12.41 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.366 -0.833 . . . . 0.0 111.24 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -99.13 -31.22 11.86 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.82 -1.175 . . . . 0.0 110.702 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 15.0 p -139.42 24.26 2.48 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.56 -1.338 . . . . 0.0 111.424 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 43.04 23.9 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.215 -0.928 . . . . 0.0 112.71 178.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.462 ' H ' ' HB3' ' A' ' 7' ' ' CYS . 5.5 t -86.83 132.1 33.93 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.373 -1.454 . . . . 0.0 110.236 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.35 -25.62 19.31 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.6 p -97.39 117.58 31.94 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.326 -0.859 . . . . 0.0 109.374 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.456 HG21 ' CH2' ' A' ' 18' ' ' TRP . 18.0 p -132.43 156.04 47.42 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.157 -0.965 . . . . 0.0 111.004 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.644 HG22 ' CG2' ' A' ' 51' ' ' ILE . 28.6 p -83.22 -40.93 18.99 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.596 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 16.6 mt -139.56 92.36 2.56 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 179.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.456 ' CH2' HG21 ' A' ' 15' ' ' THR . 10.5 m95 -57.6 127.97 34.72 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.195 -0.94 . . . . 0.0 110.148 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -116.16 86.07 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.379 -0.826 . . . . 0.0 109.122 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.46 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 12.8 mmm180 -62.63 102.73 0.36 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.371 -0.831 . . . . 0.0 109.314 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.481 ' HB2' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -63.65 143.57 97.95 Favored Pre-proline 0 N--CA 1.498 1.941 0 O-C-N 121.165 -0.959 . . . . 0.0 110.263 -179.292 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -53.99 -44.01 53.11 Favored 'Trans proline' 0 C--N 1.318 -1.03 0 C-N-CA 122.866 2.377 . . . . 0.0 111.26 -179.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -22.12 45.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.313 -0.867 . . . . 0.0 109.941 179.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.0 38.35 1.41 Allowed Glycine 0 N--CA 1.497 2.759 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 21' ' ' SER . 15.8 m-20 -128.51 98.21 26.13 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.324 -1.104 . . . . 0.0 110.082 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.497 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.9 Cg_endo -64.83 101.5 0.39 Allowed 'Trans proline' 0 C--N 1.311 -1.411 0 C-N-CA 121.956 1.771 . . . . 0.0 109.866 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.49 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -115.01 126.29 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.209 -0.932 . . . . 0.0 110.281 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.453 ' SG ' ' HB3' ' A' ' 30' ' ' ALA . 6.8 p -50.4 135.69 21.69 Favored 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.698 -0.626 . . . . 0.0 109.421 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.596 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t-20 -38.17 -43.81 0.8 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.564 -0.71 . . . . 0.0 111.384 -178.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.453 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -48.15 -45.31 33.12 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.525 -0.735 . . . . 0.0 110.359 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 51.3 m -70.3 -35.45 73.71 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.436 -0.79 . . . . 0.0 109.556 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.77 -31.73 81.87 Favored Glycine 0 N--CA 1.496 2.658 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.4 HD23 ' HA ' ' A' ' 33' ' ' LEU . 96.8 mt -79.25 -61.22 2.08 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.248 -1.148 . . . . 0.0 110.079 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.578 ' CE2' ' HB2' ' A' ' 42' ' ' ARG . 33.1 t80 -50.79 -36.03 34.94 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.379 -0.826 . . . . 0.0 108.886 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.561 ' O ' ' N ' ' A' ' 39' ' ' GLN . 18.5 t80 -59.45 -53.68 55.34 Favored 'General case' 0 C--O 1.199 -1.559 0 O-C-N 121.54 -0.725 . . . . 0.0 109.669 179.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.639 ' HD3' HD12 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -55.02 -27.41 44.19 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 119.918 -1.739 . . . . 0.0 110.267 179.616 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.639 HD12 ' HD3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -66.57 -71.14 0.21 Allowed 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.896 -1.128 . . . . 0.0 109.92 179.614 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.445 ' HB2' HG22 ' A' ' 40' ' ' VAL . 25.1 m-70 -96.19 -28.6 14.48 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.204 -0.935 . . . . 0.0 109.56 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.561 ' N ' ' O ' ' A' ' 35' ' ' TYR . 21.5 tt0 73.3 52.43 0.13 Allowed 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 122.163 0.983 . . . . 0.0 110.336 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.3 m -141.34 170.49 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -78.54 126.04 30.2 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.814 -1.179 . . . . 0.0 109.981 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.578 ' HB2' ' CE2' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -102.57 131.86 21.94 Favored Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.037 -1.04 . . . . 0.0 109.77 -179.55 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.759 ' HB2' HG23 ' A' ' 45' ' ' THR . 1.0 OUTLIER -64.51 150.66 87.85 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.283 1.989 . . . . 0.0 110.334 178.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.484 ' HB3' ' O ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -84.67 30.77 0.55 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.002 -1.061 . . . . 0.0 110.406 179.699 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . 0.759 HG23 ' HB2' ' A' ' 43' ' ' PRO . 33.8 p -70.68 -17.14 62.85 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.129 -0.982 . . . . 0.0 109.948 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.56 1.68 51.57 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.987 -1.071 . . . . 0.0 110.428 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.481 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -79.05 166.45 22.3 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 120.807 -1.183 . . . . 0.0 109.706 179.655 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 tptt -134.42 -172.55 3.04 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.36 -0.837 . . . . 0.0 109.469 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -59.85 -50.71 72.72 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.309 -0.869 . . . . 0.0 110.027 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.11 171.77 15.82 Favored Glycine 0 N--CA 1.494 2.501 0 N-CA-C 109.446 -1.462 . . . . 0.0 109.446 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.644 ' CG2' HG22 ' A' ' 16' ' ' THR . 5.3 mt -49.55 125.72 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.488 -1.007 . . . . 0.0 109.995 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -71.25 154.81 41.36 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.554 -0.716 . . . . 0.0 110.203 -179.855 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -156.32 154.08 30.04 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.843 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.454 ' NH1' ' HG2' ' A' ' 54' ' ' ARG . 0.4 OUTLIER -151.67 -164.94 2.1 Favored 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -65.57 89.74 0.11 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.995 -1.066 . . . . 0.0 108.158 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.77 175.52 1.45 Allowed 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.564 0.697 . . . . 0.0 110.365 -178.903 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt . . . . . 0 N--CA 1.489 1.515 0 O-C-N 121.626 -0.671 . . . . 0.0 109.608 179.373 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.737 0 N-CA-C 108.986 -0.746 . . . . 0.0 108.986 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.22 -14.77 6.52 Favored Glycine 0 N--CA 1.497 2.729 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 -179.082 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.658 HG23 ' HB2' ' A' ' 26' ' ' PRO . 4.3 m -62.81 89.36 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.085 -1.244 . . . . 0.0 109.631 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 6' ' ' VAL . 35.0 m -82.48 114.27 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.539 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 45.3 t -49.35 110.08 0.33 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.253 -0.904 . . . . 0.0 110.468 -178.701 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.2 m -60.37 -13.22 11.99 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.171 -0.955 . . . . 0.0 111.149 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.519 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 1.0 OUTLIER -92.54 -30.96 15.39 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.822 -1.174 . . . . 0.0 110.69 -179.654 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.519 ' SG ' ' HD2' ' A' ' 47' ' ' ARG . 16.9 p -141.82 24.87 2.0 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.932 -1.105 . . . . 0.0 111.175 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 42.67 27.61 0.1 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.308 -0.87 . . . . 0.0 112.229 179.085 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.509 HG22 ' CB ' ' A' ' 7' ' ' CYS . 6.9 t -89.88 127.49 36.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.657 -1.277 . . . . 0.0 109.975 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -90.71 -12.59 36.19 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.534 -0.729 . . . . 0.0 109.63 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.464 ' HB ' HG13 ' A' ' 51' ' ' ILE . 30.0 p -113.35 126.1 55.0 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.213 -0.93 . . . . 0.0 108.576 179.219 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.561 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 20.3 p -139.96 160.85 38.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.13 -0.981 . . . . 0.0 110.228 -179.238 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.444 HG22 HG21 ' A' ' 51' ' ' ILE . 44.6 p -91.67 -26.1 18.81 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.526 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.696 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 63.4 mt -144.09 87.45 1.9 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 179.506 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.561 ' CZ3' HG21 ' A' ' 15' ' ' THR . 6.0 m95 -57.44 106.72 0.36 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.075 -1.016 . . . . 0.0 110.543 -179.327 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.0 92.39 4.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.328 -0.858 . . . . 0.0 109.559 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.51 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 2.0 tmt_? -72.76 126.53 30.13 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.118 -0.989 . . . . 0.0 109.729 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.0 t -90.17 140.42 27.31 Favored Pre-proline 0 N--CA 1.497 1.906 0 O-C-N 121.334 -0.854 . . . . 0.0 109.782 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -55.89 -36.04 94.97 Favored 'Trans proline' 0 C--N 1.32 -0.944 0 C-N-CA 122.582 2.188 . . . . 0.0 110.908 -179.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.4 ttt -51.45 -24.9 5.51 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.517 -0.739 . . . . 0.0 109.833 178.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . 0.441 ' HA2' ' CZ ' ' A' ' 20' ' ' ARG . . . 111.22 28.51 3.8 Favored Glycine 0 N--CA 1.496 2.673 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 179.892 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -133.48 104.76 12.09 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.21 -1.17 . . . . 0.0 110.419 -179.574 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.658 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.8 Cg_endo -64.0 117.88 4.86 Favored 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.127 1.885 . . . . 0.0 109.66 178.674 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.539 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -127.58 125.24 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.055 -1.028 . . . . 0.0 110.64 -179.625 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.448 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 8.0 p -51.53 131.61 29.49 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 179.261 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.696 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 23.8 t-20 -39.63 -38.5 0.62 Allowed 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.633 -0.667 . . . . 0.0 111.34 -178.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.435 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -51.23 -43.27 61.42 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.255 -0.903 . . . . 0.0 110.279 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.519 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 12.5 m -66.92 -44.6 80.31 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.126 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.54 -31.28 77.1 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 179.128 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.445 ' HA ' HD23 ' A' ' 33' ' ' LEU . 48.5 mt -72.83 -67.61 0.55 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.331 -1.1 . . . . 0.0 110.047 -179.564 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.409 ' CE1' ' CD2' ' A' ' 38' ' ' HIS . 62.4 t80 -49.6 -35.01 19.47 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.399 -0.813 . . . . 0.0 109.638 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.537 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 13.1 t80 -61.5 -51.45 68.6 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.389 -0.819 . . . . 0.0 109.877 179.439 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -55.02 -26.34 36.5 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.28 -1.512 . . . . 0.0 110.567 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -72.96 -65.16 0.83 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.098 -1.001 . . . . 0.0 110.719 -179.308 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.492 ' HB2' HG22 ' A' ' 40' ' ' VAL . 26.2 m-70 -97.76 -27.19 14.44 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.325 -0.859 . . . . 0.0 110.213 -179.471 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.537 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 77.22 31.75 0.48 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-O 121.652 0.739 . . . . 0.0 110.779 179.876 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.6 m -121.33 175.7 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 120.911 -1.118 . . . . 0.0 109.48 178.564 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -60.82 167.92 2.57 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.164 -0.96 . . . . 0.0 110.395 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.463 ' HD3' ' HD2' ' A' ' 43' ' ' PRO . 6.5 tpp180 -135.57 103.9 10.17 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.04 -1.038 . . . . 0.0 109.462 179.907 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.463 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 6.1 Cg_exo -57.26 137.84 83.51 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 C-N-CA 122.095 1.863 . . . . 0.0 110.229 179.657 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.554 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -79.56 6.94 9.22 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.428 -0.795 . . . . 0.0 111.013 -179.608 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.7 p -56.97 -20.32 23.1 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.979 -1.075 . . . . 0.0 110.392 179.252 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -82.55 -10.04 59.15 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.949 -1.095 . . . . 0.0 110.111 179.239 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.554 ' HG3' ' HB2' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -80.42 155.91 26.89 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.88 -1.138 . . . . 0.0 109.651 -179.971 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.433 ' HA ' ' HD2' ' A' ' 48' ' ' LYS . 5.5 mmmt -125.39 -156.86 0.75 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.216 -0.928 . . . . 0.0 109.489 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -51.25 -53.08 38.83 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.174 -0.954 . . . . 0.0 109.719 179.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -139.91 -168.32 11.29 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 179.533 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.464 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.1 mt -53.75 125.36 7.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.403 -1.057 . . . . 0.0 110.063 179.92 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -66.32 142.69 57.56 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.409 -0.807 . . . . 0.0 109.427 179.322 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.39 164.22 36.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.991 -1.068 . . . . 0.0 109.771 179.578 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.79 -165.44 2.23 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -179.59 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -54.27 116.27 2.52 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.052 -1.03 . . . . 0.0 108.712 179.107 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -45.05 135.64 5.29 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.585 -0.697 . . . . 0.0 110.607 -178.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt . . . . . 0 N--CA 1.497 1.898 0 O-C-N 121.43 -0.793 . . . . 0.0 109.915 -179.987 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.77 0 CA-C-O 121.373 0.606 . . . . 0.0 109.645 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.99 -40.37 2.54 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.239 -1.944 . . . . 0.0 108.239 -178.539 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.531 HG23 ' CB ' ' A' ' 26' ' ' PRO . 54.4 m -80.63 89.21 5.7 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.381 -1.07 . . . . 0.0 109.471 179.043 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.1 m -101.59 131.26 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 33.6 t -47.63 114.98 1.0 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.544 -0.722 . . . . 0.0 111.0 -179.122 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.1 m -59.69 -13.48 10.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.087 -1.008 . . . . 0.0 110.323 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -102.51 -32.06 10.12 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.822 -1.174 . . . . 0.0 110.931 -179.814 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.479 ' HB2' ' HA ' ' A' ' 44' ' ' LEU . 13.0 p -140.63 23.34 2.3 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.602 -1.312 . . . . 0.0 111.581 -179.532 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 38.75 29.45 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.495 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 178.675 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.523 HG23 HG22 ' A' ' 15' ' ' THR . 15.3 t -86.69 132.7 33.8 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.669 -1.269 . . . . 0.0 109.403 178.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.4 p -89.31 -28.83 19.6 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.565 -0.709 . . . . 0.0 109.34 179.745 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.402 ' HB ' HG13 ' A' ' 51' ' ' ILE . 23.2 p -90.18 108.36 19.7 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.839 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.743 ' C ' HD11 ' A' ' 51' ' ' ILE . 14.6 p -127.08 144.36 51.05 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.161 -0.962 . . . . 0.0 109.937 -179.527 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 30.9 p -65.96 -36.27 82.87 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.122 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.515 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -149.08 120.31 7.81 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.055 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.571 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.6 m95 -73.6 95.32 2.28 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.454 -0.779 . . . . 0.0 109.808 -179.452 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 77.11 2.3 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.403 -0.811 . . . . 0.0 108.82 179.629 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.5 mmt180 -61.19 95.3 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.454 -0.779 . . . . 0.0 109.059 -179.795 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.2 144.31 94.69 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.394 -0.816 . . . . 0.0 109.967 -179.162 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -58.69 -20.91 53.18 Favored 'Trans proline' 0 C--N 1.32 -0.973 0 C-N-CA 122.47 2.113 . . . . 0.0 110.672 179.85 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.8 0.04 25.31 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.18 -0.95 . . . . 0.0 109.9 178.978 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.66 32.57 15.15 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 109.433 -1.467 . . . . 0.0 109.433 -179.48 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -129.51 96.59 26.93 Favored Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 121.443 -1.034 . . . . 0.0 110.553 -179.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.531 ' CB ' HG23 ' A' ' 5' ' ' THR . 2.6 Cg_endo -64.16 111.38 1.58 Allowed 'Trans proline' 0 C--N 1.314 -1.244 0 C-N-CA 122.223 1.949 . . . . 0.0 110.172 178.89 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.494 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -121.45 124.77 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.418 -0.801 . . . . 0.0 110.078 179.896 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.444 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 5.0 p -48.46 135.7 13.76 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.589 -0.694 . . . . 0.0 109.886 179.663 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.515 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 4.6 t-20 -37.04 -44.51 0.53 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.62 -0.675 . . . . 0.0 112.2 -178.608 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -49.66 -51.92 34.64 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.421 -0.8 . . . . 0.0 110.235 -179.703 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 63.6 m -63.63 -39.54 94.6 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.301 -0.875 . . . . 0.0 109.537 179.665 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.0 -36.13 91.8 Favored Glycine 0 N--CA 1.498 2.806 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 179.663 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.433 ' O ' HD13 ' A' ' 37' ' ' LEU . 85.7 mt -73.21 -66.55 0.67 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.395 -1.062 . . . . 0.0 109.985 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.826 ' HA ' HD22 ' A' ' 37' ' ' LEU . 8.3 t80 -49.11 -40.44 32.18 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.235 -0.916 . . . . 0.0 109.114 179.628 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.465 ' O ' ' N ' ' A' ' 39' ' ' GLN . 38.2 t80 -51.0 -48.63 61.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.633 -0.667 . . . . 0.0 109.405 179.486 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.39 -38.46 87.57 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.065 -1.022 . . . . 0.0 110.248 179.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.826 HD22 ' HA ' ' A' ' 34' ' ' TYR . 5.1 mp -41.08 -51.37 3.37 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.507 -0.745 . . . . 0.0 110.197 -179.577 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.664 ' HB2' HG22 ' A' ' 40' ' ' VAL . 4.1 m-70 -127.91 17.73 6.74 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.27 -0.893 . . . . 0.0 109.555 179.298 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.465 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.3 OUTLIER 47.22 46.77 16.66 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.817 0.817 . . . . 0.0 109.597 -178.989 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.664 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.8 m -133.6 164.36 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 O-C-N 121.41 -0.806 . . . . 0.0 109.963 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -77.97 163.06 26.3 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.431 -0.793 . . . . 0.0 110.351 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.614 ' HB2' ' CD1' ' A' ' 34' ' ' TYR . 4.4 tpt180 -130.14 121.02 19.44 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.222 -0.924 . . . . 0.0 109.222 179.289 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.02 147.0 91.82 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 C-N-CA 121.925 1.75 . . . . 0.0 110.432 179.807 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.479 ' HA ' ' HB2' ' A' ' 10' ' ' CYS . 1.7 pt? -63.08 -10.99 16.62 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.442 -0.786 . . . . 0.0 110.921 179.588 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.9 t -48.73 -31.07 6.32 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.208 -0.933 . . . . 0.0 110.824 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.3 ttt -80.68 -39.66 26.83 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.162 -0.961 . . . . 0.0 109.426 179.656 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.486 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.8 OUTLIER -61.8 129.21 39.92 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.111 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.16 -149.56 0.36 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.281 -0.887 . . . . 0.0 109.685 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -50.63 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.433 -0.792 . . . . 0.0 110.899 -179.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.02 -168.45 13.1 Favored Glycine 0 N--CA 1.495 2.587 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 -179.752 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.743 HD11 ' C ' ' A' ' 15' ' ' THR . 13.9 mt -48.05 129.53 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.606 -0.938 . . . . 0.0 110.455 -179.772 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -76.36 78.68 3.11 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.3 -0.875 . . . . 0.0 109.861 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.47 161.15 26.25 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.401 -0.812 . . . . 0.0 109.638 179.591 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.427 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.4 OUTLIER -150.77 -153.63 0.5 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.61 -0.681 . . . . 0.0 109.767 -179.501 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -74.97 128.94 36.75 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.06 -1.025 . . . . 0.0 108.724 179.031 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.59 133.64 10.1 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.586 -0.696 . . . . 0.0 110.643 -179.349 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt . . . . . 0 N--CA 1.497 1.883 0 O-C-N 121.366 -0.834 . . . . 0.0 109.497 179.801 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.752 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.53 -33.54 3.58 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 -179.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.594 HG23 ' HB2' ' A' ' 26' ' ' PRO . 27.2 m -62.77 90.75 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.32 -1.106 . . . . 0.0 108.787 178.95 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 6' ' ' VAL . 9.5 m -84.96 112.66 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.069 -1.019 . . . . 0.0 108.379 -179.975 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.505 ' O ' ' N ' ' A' ' 11' ' ' GLN . 44.8 t -47.45 113.7 0.74 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.428 -0.795 . . . . 0.0 109.917 -179.157 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 62.0 m -66.68 -12.56 58.86 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.021 -1.049 . . . . 0.0 111.001 -179.247 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.461 ' ND2' HG11 ' A' ' 27' ' ' VAL . 0.9 OUTLIER -89.62 -31.31 17.61 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.84 -1.162 . . . . 0.0 110.228 179.879 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.47 ' SG ' HG22 ' A' ' 12' ' ' THR . 16.8 p -140.46 17.4 2.38 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.887 -1.133 . . . . 0.0 111.057 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 7' ' ' CYS . 11.5 mt-30 51.49 21.2 1.19 Allowed 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.989 -1.069 . . . . 0.0 111.801 178.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.47 HG22 ' SG ' ' A' ' 10' ' ' CYS . 6.3 t -87.61 136.47 32.93 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.681 -1.262 . . . . 0.0 110.564 -179.724 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -27.12 18.93 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.302 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.517 HG21 ' HA2' ' A' ' 50' ' ' GLY . 18.6 p -90.06 127.09 35.99 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.416 -0.802 . . . . 0.0 109.537 179.527 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.696 HG21 ' CH2' ' A' ' 18' ' ' TRP . 10.3 p -145.69 144.09 30.18 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.409 -0.807 . . . . 0.0 110.225 -179.558 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.552 HG22 HG23 ' A' ' 51' ' ' ILE . 20.2 p -72.63 -28.59 62.85 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.329 -0.857 . . . . 0.0 109.098 179.139 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.587 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -152.71 117.17 4.98 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.173 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.696 ' CH2' HG21 ' A' ' 15' ' ' THR . 8.0 m95 -73.82 108.81 6.87 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.183 -0.948 . . . . 0.0 110.09 -179.02 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -99.3 94.47 6.48 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.133 -0.979 . . . . 0.0 109.452 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.436 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.3 tpp180 -66.6 102.71 0.95 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 108.364 179.364 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -56.36 146.74 51.62 Favored Pre-proline 0 N--CA 1.5 2.052 0 O-C-N 121.388 -0.82 . . . . 0.0 110.209 -178.718 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -52.92 -43.91 52.82 Favored 'Trans proline' 0 C--N 1.319 -0.995 0 C-N-CA 122.702 2.268 . . . . 0.0 111.07 -179.05 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.6 ttp -57.59 -23.49 51.11 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.414 -0.804 . . . . 0.0 109.717 179.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.35 38.22 1.38 Allowed Glycine 0 N--CA 1.496 2.665 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' A' ' 21' ' ' SER . 60.5 m-20 -128.3 110.09 19.54 Favored Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.1 -1.236 . . . . 0.0 110.491 -179.841 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.594 ' HB2' HG23 ' A' ' 5' ' ' THR . 3.5 Cg_exo -62.92 109.86 1.01 Allowed 'Trans proline' 0 C--N 1.313 -1.313 0 C-N-CA 122.011 1.807 . . . . 0.0 110.062 178.627 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.461 HG11 ' ND2' ' A' ' 9' ' ' ASN . 2.1 m -121.56 131.38 73.21 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.163 -0.961 . . . . 0.0 110.407 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.471 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.8 p -55.03 132.55 47.4 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.663 -0.648 . . . . 0.0 109.305 179.556 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.587 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 16.7 t-20 -35.58 -46.09 0.39 Allowed 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.87 -0.519 . . . . 0.0 112.162 -178.313 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.77 -45.46 59.0 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.347 -0.845 . . . . 0.0 110.206 -179.688 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.432 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 19.4 m -65.53 -39.34 91.68 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.177 -0.952 . . . . 0.0 109.001 179.263 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.22 -43.39 95.45 Favored Glycine 0 N--CA 1.497 2.743 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.446 ' O ' HD13 ' A' ' 37' ' ' LEU . 46.6 mt -75.69 -57.46 3.87 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.454 -1.027 . . . . 0.0 109.698 -179.831 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.631 ' HA ' HD22 ' A' ' 37' ' ' LEU . 26.9 t80 -51.84 -38.56 56.39 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.512 -0.742 . . . . 0.0 109.046 179.475 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.478 ' O ' ' N ' ' A' ' 39' ' ' GLN . 44.8 t80 -56.35 -45.56 80.38 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 178.705 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.04 -39.4 93.29 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.066 -1.021 . . . . 0.0 109.899 179.319 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.631 HD22 ' HA ' ' A' ' 34' ' ' TYR . 5.8 mp -44.88 -59.12 2.71 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.562 -0.711 . . . . 0.0 110.128 -179.466 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.527 ' CB ' HG22 ' A' ' 40' ' ' VAL . 87.9 m-70 -104.14 4.64 34.34 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.45 -0.781 . . . . 0.0 109.415 178.828 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 49.7 33.83 6.62 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.565 -0.709 . . . . 0.0 110.027 -178.702 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.527 HG22 ' CB ' ' A' ' 38' ' ' HIS . 11.1 m -140.17 163.79 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 O-C-N 121.463 -0.773 . . . . 0.0 110.018 -179.612 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -82.17 140.97 33.44 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.335 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.551 ' HG3' ' CE2' ' A' ' 34' ' ' TYR . 2.3 mmm180 -127.99 150.39 73.5 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.014 -1.054 . . . . 0.0 110.09 -179.493 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -57.09 151.68 49.07 Favored 'Trans proline' 0 C--N 1.315 -1.211 0 C-N-CA 123.005 2.47 . . . . 0.0 111.814 -179.074 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.443 ' HB2' ' HD3' ' A' ' 47' ' ' ARG . 1.0 OUTLIER -71.57 10.18 0.7 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.594 -0.691 . . . . 0.0 111.568 179.793 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.02 -32.41 61.82 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.611 -1.305 . . . . 0.0 110.18 179.54 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.07 -12.78 49.24 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.399 -0.813 . . . . 0.0 110.346 179.515 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.443 ' HD3' ' HB2' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -58.71 162.11 4.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.903 -1.123 . . . . 0.0 109.965 179.822 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.28 149.76 46.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.458 -0.776 . . . . 0.0 109.456 178.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -63.81 -35.01 79.21 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.493 -0.754 . . . . 0.0 110.175 -179.862 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . 0.517 ' HA2' HG21 ' A' ' 14' ' ' THR . . . -134.53 157.0 22.73 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 179.318 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.552 HG23 HG22 ' A' ' 16' ' ' THR . 4.9 mt -53.31 119.5 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.157 -1.202 . . . . 0.0 109.987 -179.618 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.484 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -75.6 167.28 22.19 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.634 -0.666 . . . . 0.0 109.206 179.755 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.484 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -154.98 160.67 41.27 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.571 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.47 -161.66 1.39 Allowed 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -179.617 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.37 94.46 0.06 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.825 -1.172 . . . . 0.0 108.924 179.302 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.1 ptp180 -54.49 143.84 22.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.483 -0.761 . . . . 0.0 109.97 -179.502 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp . . . . . 0 N--CA 1.493 1.716 0 O-C-N 121.358 -0.839 . . . . 0.0 109.152 179.797 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.812 0 CA-C-O 121.239 0.542 . . . . 0.0 109.709 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.91 -18.23 12.68 Favored Glycine 0 N--CA 1.495 2.596 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 5' ' ' THR . 15.2 m -76.46 85.57 3.19 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.82 -1.4 . . . . 0.0 110.314 -179.789 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 m -85.77 120.37 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 178.18 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 51.5 t -45.46 111.55 0.35 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.206 -0.934 . . . . 0.0 110.202 -178.327 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 71.8 m -59.71 -14.31 13.64 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.171 -0.956 . . . . 0.0 111.437 -179.212 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.541 ' OD1' ' HD2' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -95.39 -30.83 13.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.634 -1.291 . . . . 0.0 110.734 -179.572 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.486 ' SG ' ' HD3' ' A' ' 47' ' ' ARG . 18.4 p -141.26 28.37 1.87 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.897 -1.127 . . . . 0.0 110.492 179.289 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.576 HE22 HD22 ' A' ' 44' ' ' LEU . 5.5 pm0 34.22 30.19 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.728 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 179.781 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.453 ' H ' ' HB3' ' A' ' 7' ' ' CYS . 5.1 t -90.88 132.56 35.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.747 -1.22 . . . . 0.0 109.844 179.479 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.2 p -90.29 -28.6 18.67 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.237 -0.914 . . . . 0.0 109.107 179.379 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.7 p -89.86 111.04 21.95 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.431 -0.793 . . . . 0.0 109.479 179.5 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.549 HG21 ' CH2' ' A' ' 18' ' ' TRP . 9.5 p -130.97 166.52 20.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.332 -0.855 . . . . 0.0 110.205 -179.712 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.496 HG22 HG21 ' A' ' 51' ' ' ILE . 16.2 p -89.41 -40.57 12.63 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.353 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 14.3 mt -141.89 112.56 7.22 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.321 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.549 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.0 m95 -69.67 88.72 0.53 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.304 -0.873 . . . . 0.0 109.608 -179.389 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.78 84.85 7.2 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.61 -0.682 . . . . 0.0 109.424 -179.913 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 9.3 tpp180 -62.17 120.83 11.67 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.113 -0.992 . . . . 0.0 109.213 179.726 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.59 144.01 68.84 Favored Pre-proline 0 N--CA 1.498 1.932 0 O-C-N 121.298 -0.876 . . . . 0.0 110.187 -179.439 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -56.45 -42.49 65.09 Favored 'Trans proline' 0 C--N 1.319 -1.014 0 C-N-CA 122.737 2.291 . . . . 0.0 111.197 -179.294 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -21.03 39.62 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.299 -0.875 . . . . 0.0 110.061 179.486 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.63 35.92 1.65 Allowed Glycine 0 N--CA 1.497 2.759 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -127.03 102.75 24.13 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.207 -1.172 . . . . 0.0 110.142 -179.796 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.494 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.6 Cg_endo -64.02 98.56 0.26 Allowed 'Trans proline' 0 C--N 1.312 -1.364 0 C-N-CA 122.162 1.908 . . . . 0.0 109.604 178.793 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.474 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.0 m -109.74 153.94 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 CA-C-O 122.348 1.07 . . . . 0.0 111.114 -179.622 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.467 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 15.3 p -81.48 138.72 35.47 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.433 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 4.7 t-20 -37.96 -37.24 0.24 Allowed 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.695 -0.628 . . . . 0.0 111.971 -178.799 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.39 -42.77 95.94 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.09 -1.006 . . . . 0.0 111.695 -179.329 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.508 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 4.9 m -61.52 -40.67 95.47 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.212 -0.93 . . . . 0.0 109.088 -179.934 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.4 -49.02 54.53 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.427 ' O ' HD13 ' A' ' 37' ' ' LEU . 94.8 mt -60.58 -58.41 8.6 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.638 -0.919 . . . . 0.0 109.63 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.624 ' CE1' ' HD2' ' A' ' 43' ' ' PRO . 20.4 t80 -54.51 -43.84 72.21 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.543 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.507 ' CD2' ' O ' ' A' ' 40' ' ' VAL . 20.0 t80 -51.91 -46.57 64.66 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.508 -0.745 . . . . 0.0 109.073 179.27 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -63.34 -41.92 98.9 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.214 -0.929 . . . . 0.0 110.152 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.568 HD22 ' HA ' ' A' ' 34' ' ' TYR . 3.9 mp -45.36 -59.28 2.76 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.329 -0.857 . . . . 0.0 110.427 -179.439 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.516 ' CB ' HG22 ' A' ' 40' ' ' VAL . 53.4 m-70 -102.61 6.42 39.71 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.374 -0.829 . . . . 0.0 109.853 179.565 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.448 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.6 OUTLIER 46.7 31.89 1.55 Allowed 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.51 -0.744 . . . . 0.0 110.299 -179.212 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.516 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.9 m -134.61 -161.47 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 O-C-N 121.476 -0.765 . . . . 0.0 109.048 179.652 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -59.1 -175.01 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.996 -1.065 . . . . 0.0 110.596 -179.883 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.541 ' HD2' ' OD1' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -141.1 102.91 6.17 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.106 -0.996 . . . . 0.0 109.969 -179.189 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.624 ' HD2' ' CE1' ' A' ' 34' ' ' TYR . 3.9 Cg_exo -60.62 126.05 18.87 Favored 'Trans proline' 0 C--N 1.315 -1.186 0 C-N-CA 121.991 1.794 . . . . 0.0 110.08 179.753 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.576 HD22 HE22 ' A' ' 11' ' ' GLN . 1.3 pp -85.05 16.43 3.47 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.385 -0.822 . . . . 0.0 110.935 -179.836 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 p -68.45 -5.65 20.46 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.02 -1.05 . . . . 0.0 111.07 -179.917 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 65.9 mtp -94.23 -26.79 16.49 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.883 -1.136 . . . . 0.0 110.144 179.948 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.486 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -65.25 154.4 38.25 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.215 -0.928 . . . . 0.0 110.264 179.994 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.36 -158.61 0.9 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.921 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.08 -39.1 84.9 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.288 -0.882 . . . . 0.0 109.693 179.384 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.07 -175.33 14.13 Favored Glycine 0 N--CA 1.5 2.931 0 N-CA-C 110.19 -1.164 . . . . 0.0 110.19 179.513 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.496 HG21 HG22 ' A' ' 16' ' ' THR . 3.8 mt -62.31 137.12 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.286 -1.126 . . . . 0.0 108.965 179.453 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.66 79.87 0.07 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.22 -0.925 . . . . 0.0 111.047 -178.638 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.06 159.54 15.43 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.137 -0.977 . . . . 0.0 110.4 179.564 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.64 -159.11 0.99 Allowed 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -52.56 103.15 0.06 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.833 -1.167 . . . . 0.0 109.159 179.208 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.5 ttm180 -50.74 140.8 14.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.369 -0.832 . . . . 0.0 110.339 -178.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.57 0 O-C-N 121.475 -0.766 . . . . 0.0 109.281 179.077 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.79 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.25 -26.52 5.51 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.399 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.478 HG23 ' CB ' ' A' ' 26' ' ' PRO . 70.8 m -68.4 92.64 0.44 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.302 -1.117 . . . . 0.0 109.089 179.295 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -90.91 138.26 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.283 -0.886 . . . . 0.0 108.722 179.839 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.748 ' HB2' HG22 ' A' ' 12' ' ' THR . 24.6 t -62.42 118.08 7.02 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.146 -0.971 . . . . 0.0 110.973 -179.35 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 m -60.4 -15.47 26.52 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.387 -0.821 . . . . 0.0 110.295 178.85 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.673 ' OD1' HG11 ' A' ' 27' ' ' VAL . 9.0 m120 -102.82 -30.4 10.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.065 -1.022 . . . . 0.0 110.852 -179.764 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.493 ' SG ' ' HG3' ' A' ' 47' ' ' ARG . 12.8 p -142.66 23.43 1.94 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.672 -1.268 . . . . 0.0 111.909 -179.306 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 38.25 37.5 0.16 Allowed 'General case' 0 N--CA 1.511 2.597 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 178.483 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.748 HG22 ' HB2' ' A' ' 7' ' ' CYS . 5.3 t -88.14 135.13 33.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.527 -1.358 . . . . 0.0 108.694 178.333 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.4 p -90.44 -10.79 42.45 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.159 -0.963 . . . . 0.0 109.736 179.922 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.422 ' HB ' HG13 ' A' ' 51' ' ' ILE . 34.7 p -121.26 132.53 54.86 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.217 -0.927 . . . . 0.0 108.697 178.926 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 6.5 p -145.74 157.18 43.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.411 -0.806 . . . . 0.0 109.668 -179.811 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 18.4 p -77.93 -35.63 50.24 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.281 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.522 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.6 mt -146.53 106.58 4.0 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.599 -0.688 . . . . 0.0 109.486 179.638 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.43 ' CH2' HG22 ' A' ' 5' ' ' THR . 13.6 m95 -65.3 111.69 3.13 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.555 -0.715 . . . . 0.0 110.497 -179.372 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.29 72.07 5.3 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.242 -0.911 . . . . 0.0 109.126 179.276 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.51 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.9 OUTLIER -61.98 110.49 1.58 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.204 -0.935 . . . . 0.0 109.277 -179.965 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . 0.421 ' OG ' ' HD2' ' A' ' 22' ' ' PRO . 0.1 OUTLIER -75.2 154.2 86.3 Favored Pre-proline 0 N--CA 1.497 1.905 0 O-C-N 121.298 -0.876 . . . . 0.0 110.036 -179.705 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . 0.421 ' HD2' ' OG ' ' A' ' 21' ' ' SER . 4.7 Cg_exo -53.39 -48.14 23.57 Favored 'Trans proline' 0 C--N 1.319 -1.017 0 C-N-CA 122.762 2.308 . . . . 0.0 111.407 -178.943 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.0 -21.58 59.21 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.341 -0.849 . . . . 0.0 110.05 179.503 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.44 50.59 0.65 Allowed Glycine 0 N--CA 1.496 2.689 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 -179.81 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -127.46 89.58 50.91 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.574 -0.956 . . . . 0.0 109.994 -179.377 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.51 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 1.4 Cg_endo -66.4 94.51 0.31 Allowed 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 122.299 1.999 . . . . 0.0 110.0 179.434 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.673 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.4 m -109.69 125.86 66.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.06 -1.025 . . . . 0.0 110.52 -179.833 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.563 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 5.2 p -49.98 134.26 21.69 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.674 -0.641 . . . . 0.0 110.07 179.786 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.522 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 1.7 t-20 -36.77 -47.74 0.69 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.876 -0.515 . . . . 0.0 111.519 -178.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.39 -46.2 25.86 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.43 -0.794 . . . . 0.0 110.578 -179.66 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 27.0 m -66.34 -43.8 85.08 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.21 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.51 -32.17 68.27 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 110.114 -1.194 . . . . 0.0 110.114 179.069 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 33' ' ' LEU . 61.0 mt -79.53 -62.29 1.74 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.334 -1.098 . . . . 0.0 109.844 179.905 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -50.99 -36.73 40.72 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.292 -0.88 . . . . 0.0 108.79 179.346 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.512 ' O ' ' N ' ' A' ' 39' ' ' GLN . 31.0 t80 -61.88 -46.49 89.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.45 -0.781 . . . . 0.0 109.712 179.298 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -22.03 57.96 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.259 -1.525 . . . . 0.0 110.079 179.457 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.1 mp -74.54 -71.82 0.32 Allowed 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.976 -1.078 . . . . 0.0 109.851 179.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.452 ' HB2' HG22 ' A' ' 40' ' ' VAL . 51.7 m-70 -93.95 -18.81 21.53 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.309 -0.869 . . . . 0.0 110.477 -179.901 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.512 ' N ' ' O ' ' A' ' 35' ' ' TYR . 2.3 tt0 61.54 53.36 3.36 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-O 122.192 0.996 . . . . 0.0 109.951 -179.897 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.452 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.6 m -138.51 168.08 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.185 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.403 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 9.7 p-10 -70.24 126.15 28.83 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.813 -1.179 . . . . 0.0 109.337 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.414 ' CD ' ' HD2' ' A' ' 43' ' ' PRO . 5.4 tpt180 -96.62 110.53 53.53 Favored Pre-proline 0 N--CA 1.493 1.706 0 O-C-N 121.205 -0.934 . . . . 0.0 109.735 -179.444 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.414 ' HD2' ' CD ' ' A' ' 42' ' ' ARG . 6.2 Cg_exo -56.15 147.21 66.63 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 C-N-CA 121.976 1.784 . . . . 0.0 110.408 179.272 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.406 ' HB2' ' HD2' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -71.27 7.73 1.22 Allowed 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.429 -0.794 . . . . 0.0 111.615 -179.795 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -50.25 -30.68 12.26 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.905 -1.122 . . . . 0.0 109.933 179.232 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.0 ttp -103.56 -24.13 13.44 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.342 -0.849 . . . . 0.0 110.227 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.496 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -59.22 143.52 48.81 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.152 -0.967 . . . . 0.0 109.92 -179.858 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HB2' ' OE1' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -123.39 157.21 33.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.261 -0.899 . . . . 0.0 109.709 179.587 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -71.37 -29.71 65.28 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.599 -0.688 . . . . 0.0 110.323 -179.596 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -111.71 132.6 10.95 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 179.548 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.422 HG13 ' HB ' ' A' ' 14' ' ' THR . 4.9 mt -51.04 125.11 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.724 -0.868 . . . . 0.0 110.63 -179.783 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.465 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -73.72 157.17 37.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.609 -0.682 . . . . 0.0 109.61 179.24 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.06 164.15 38.25 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.01 -1.056 . . . . 0.0 109.825 179.201 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.92 -158.79 0.95 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.587 -0.696 . . . . 0.0 109.383 -179.677 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -55.83 98.47 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.899 -1.126 . . . . 0.0 108.961 179.215 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -49.99 139.74 13.38 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.499 -0.751 . . . . 0.0 110.818 -178.602 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.49 1.539 0 O-C-N 121.584 -0.698 . . . . 0.0 109.432 179.455 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.756 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.95 -11.23 6.96 Favored Glycine 0 N--CA 1.497 2.726 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 -179.192 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.46 HG22 ' CH2' ' A' ' 18' ' ' TRP . 93.9 m -65.45 88.53 0.09 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.071 -1.253 . . . . 0.0 109.626 179.702 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 6' ' ' VAL . 24.9 m -88.53 112.08 23.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 179.16 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.551 ' CB ' HG22 ' A' ' 12' ' ' THR . 52.7 t -46.88 113.36 0.65 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.277 -0.889 . . . . 0.0 110.071 -178.486 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.1 m -61.17 -14.81 27.82 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.359 -0.838 . . . . 0.0 111.073 -179.484 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.427 ' CB ' ' SG ' ' A' ' 31' ' ' CYS . 12.1 m-20 -94.76 -30.09 14.43 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.863 -1.148 . . . . 0.0 110.988 -179.485 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.596 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 18.5 p -139.66 19.84 2.52 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.56 -1.338 . . . . 0.0 111.383 179.598 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 7' ' ' CYS . 3.9 mt-30 45.81 26.17 0.35 Allowed 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.233 -0.917 . . . . 0.0 111.97 179.014 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.551 HG22 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -84.94 136.7 33.51 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.709 -1.244 . . . . 0.0 109.977 179.684 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 p -93.48 1.54 56.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.565 -0.71 . . . . 0.0 109.427 178.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.466 ' HB ' HG13 ' A' ' 51' ' ' ILE . 79.2 p -127.42 130.9 50.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.047 -1.033 . . . . 0.0 110.111 -179.606 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.699 ' C ' HD11 ' A' ' 51' ' ' ILE . 9.3 p -147.89 143.03 27.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.443 -0.786 . . . . 0.0 109.771 179.625 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.509 HG22 ' CG2' ' A' ' 51' ' ' ILE . 44.6 p -72.12 -33.57 67.91 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 178.791 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . . . . . . . . . 69.3 mt -142.39 105.54 4.59 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.067 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.603 ' CZ3' HG21 ' A' ' 15' ' ' THR . 12.5 m95 -64.77 86.34 0.05 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.418 -0.802 . . . . 0.0 109.656 -179.877 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.33 81.39 0.37 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 109.73 -179.795 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HD3' ' CA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.96 101.45 0.21 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.073 -1.017 . . . . 0.0 108.766 179.517 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.93 141.72 47.45 Favored Pre-proline 0 N--CA 1.497 1.894 0 O-C-N 121.411 -0.806 . . . . 0.0 109.997 -179.034 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -53.88 -36.21 82.44 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 122.504 2.136 . . . . 0.0 110.962 -179.318 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . 0.45 ' CE ' ' HA ' ' A' ' 23' ' ' MET . 1.1 tpt -60.03 -22.21 62.35 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.365 -0.834 . . . . 0.0 109.871 179.318 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.92 33.25 2.05 Favored Glycine 0 N--CA 1.497 2.722 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.659 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -126.09 113.0 24.07 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.172 -1.193 . . . . 0.0 110.42 -179.557 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.473 ' CA ' ' HD3' ' A' ' 20' ' ' ARG . 3.2 Cg_exo -64.1 100.1 0.3 Allowed 'Trans proline' 0 C--N 1.316 -1.174 0 C-N-CA 122.313 2.009 . . . . 0.0 110.083 178.879 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.5 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -119.88 127.17 75.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.126 -0.984 . . . . 0.0 110.149 179.947 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.478 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 8.3 p -51.43 136.54 25.44 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.479 -0.763 . . . . 0.0 109.397 179.331 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -43.36 -43.42 5.08 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.418 -0.801 . . . . 0.0 111.611 -178.252 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.34 -44.38 34.27 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.255 -0.903 . . . . 0.0 110.287 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.427 ' SG ' ' CB ' ' A' ' 9' ' ' ASN . 5.4 m -63.69 -43.67 95.94 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.342 -0.849 . . . . 0.0 109.229 179.235 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.4 -57.18 15.97 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 110.35 -1.1 . . . . 0.0 110.35 -179.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 16.9 mt -60.77 -55.79 28.97 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.452 -1.028 . . . . 0.0 109.357 -179.998 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.454 ' OH ' ' HG3' ' A' ' 42' ' ' ARG . 75.0 t80 -49.95 -43.88 50.23 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.613 -0.68 . . . . 0.0 109.597 179.498 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -56.17 -45.93 79.53 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.301 -0.874 . . . . 0.0 109.285 179.388 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.36 -30.94 71.54 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.095 -1.003 . . . . 0.0 110.142 179.435 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 34' ' ' TYR . 4.7 mp -61.73 -65.62 0.66 Allowed 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.098 -1.001 . . . . 0.0 110.625 -179.608 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.829 ' O ' HG22 ' A' ' 40' ' ' VAL . 59.8 m-70 -95.59 9.32 40.61 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.221 -0.924 . . . . 0.0 110.532 -179.66 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER 41.08 32.51 0.18 Allowed 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.519 -0.738 . . . . 0.0 111.424 -179.182 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.829 HG22 ' O ' ' A' ' 38' ' ' HIS . 4.5 m -145.57 169.77 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 121.281 -0.887 . . . . 0.0 109.807 179.759 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -85.85 154.23 21.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.262 -0.898 . . . . 0.0 109.368 178.899 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.454 ' HG3' ' OH ' ' A' ' 34' ' ' TYR . 30.0 mmt180 -149.98 151.18 31.69 Favored Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 121.061 -1.024 . . . . 0.0 109.77 179.519 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -59.33 147.51 90.7 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 C-N-CA 122.205 1.936 . . . . 0.0 110.785 179.961 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.596 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -89.73 37.64 0.88 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.123 -0.986 . . . . 0.0 110.806 -179.781 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.0 p -70.59 -11.28 60.84 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.011 -1.055 . . . . 0.0 109.971 178.894 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 1.4 tmm? -88.1 -18.55 28.6 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.236 -0.915 . . . . 0.0 110.445 179.64 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.489 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -57.24 139.01 53.98 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.89 -1.131 . . . . 0.0 110.036 -179.889 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -99.49 -177.57 3.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.387 -0.821 . . . . 0.0 109.493 -179.981 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -64.04 -37.5 87.66 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.253 -0.904 . . . . 0.0 110.032 -179.811 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -142.8 171.21 24.92 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.637 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.699 HD11 ' C ' ' A' ' 15' ' ' THR . 14.5 mt -54.44 121.87 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.381 -1.07 . . . . 0.0 109.861 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -68.35 146.83 52.9 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.39 -0.819 . . . . 0.0 108.822 179.182 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.38 157.59 41.5 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.297 -0.877 . . . . 0.0 109.763 179.278 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.426 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -152.44 -168.71 3.13 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 -179.904 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -61.8 105.5 0.56 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.885 -1.134 . . . . 0.0 108.279 179.012 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 2.8 ptp180 -45.25 135.37 5.86 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.286 -0.884 . . . . 0.0 110.048 -178.583 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.492 1.652 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.511 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.814 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 109.03 -30.34 8.77 Favored Glycine 0 N--CA 1.498 2.825 0 N-CA-C 109.531 -1.427 . . . . 0.0 109.531 -179.348 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.726 HG23 ' HB2' ' A' ' 26' ' ' PRO . 16.2 m -78.62 90.24 4.55 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.128 -1.219 . . . . 0.0 109.579 179.654 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 6' ' ' VAL . 27.9 m -81.93 116.13 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 179.175 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.467 ' CB ' HG22 ' A' ' 12' ' ' THR . 41.3 t -49.1 113.87 0.89 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.203 -0.935 . . . . 0.0 110.11 -178.61 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -60.11 -15.29 22.23 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.635 -0.666 . . . . 0.0 111.141 -179.497 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.417 ' OD1' HG11 ' A' ' 27' ' ' VAL . 5.8 m-20 -96.69 -30.64 13.11 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.911 -1.118 . . . . 0.0 111.376 -179.051 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.542 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 15.6 p -140.49 26.16 2.16 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.698 -1.251 . . . . 0.0 111.189 179.939 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 40.56 27.88 0.04 OUTLIER 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.161 -0.962 . . . . 0.0 112.627 178.422 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.467 HG22 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -89.59 136.78 32.83 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.569 -1.332 . . . . 0.0 110.081 179.925 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.0 p -92.22 -30.42 15.92 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.493 -0.754 . . . . 0.0 109.033 179.168 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.5 p -92.45 125.32 37.05 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.364 -0.835 . . . . 0.0 109.601 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.598 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 16.4 p -143.3 148.94 37.12 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.165 -0.96 . . . . 0.0 110.814 179.961 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.552 HG22 HG21 ' A' ' 51' ' ' ILE . 70.6 p -73.87 -33.92 64.25 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.956 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.497 ' HA ' HD23 ' A' ' 17' ' ' LEU . 15.6 mt -150.87 105.45 3.27 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.405 -0.81 . . . . 0.0 108.92 179.536 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.598 ' CZ3' HG21 ' A' ' 15' ' ' THR . 7.0 m95 -63.49 84.22 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.421 -0.799 . . . . 0.0 110.936 -178.856 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.452 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.3 OUTLIER -80.43 77.51 7.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.08 -1.012 . . . . 0.0 109.194 179.36 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.559 ' CB ' ' HA ' ' A' ' 26' ' ' PRO . 5.2 ppt_? -80.0 138.62 37.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.022 -1.049 . . . . 0.0 110.033 -179.56 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -86.89 148.27 45.2 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.255 -0.903 . . . . 0.0 109.944 -179.802 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -55.0 -31.3 73.85 Favored 'Trans proline' 0 C--N 1.319 -1.026 0 C-N-CA 122.522 2.148 . . . . 0.0 111.024 -179.7 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.04 -28.56 53.12 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.409 -0.807 . . . . 0.0 109.803 179.195 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 117.09 34.52 1.22 Allowed Glycine 0 N--CA 1.497 2.713 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 179.678 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -130.88 96.03 24.02 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.281 -1.129 . . . . 0.0 109.911 -179.794 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.726 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.3 Cg_endo -65.17 106.21 0.79 Allowed 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 122.465 2.11 . . . . 0.0 110.31 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.457 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -119.1 129.27 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.071 -1.018 . . . . 0.0 110.428 -179.985 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.469 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 6.6 p -52.33 133.57 34.55 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 121.387 -0.82 . . . . 0.0 109.42 179.468 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 18.9 t-20 -34.34 -49.73 0.39 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.724 -0.61 . . . . 0.0 112.203 -178.445 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -46.82 -49.05 20.65 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.383 -0.823 . . . . 0.0 110.767 -179.424 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 27.1 m -62.56 -45.46 92.83 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.383 -0.823 . . . . 0.0 109.096 179.533 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.21 -30.59 64.4 Favored Glycine 0 N--CA 1.494 2.553 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 179.832 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 33' ' ' LEU . 60.6 mt -80.34 -63.12 1.48 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.391 -1.064 . . . . 0.0 109.8 -179.9 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -52.59 -35.17 53.67 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.32 -0.862 . . . . 0.0 109.174 179.635 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.6 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 8.5 t80 -66.37 -52.81 42.99 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.515 -0.74 . . . . 0.0 110.232 179.493 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -54.84 -28.42 49.68 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.135 -1.603 . . . . 0.0 109.985 -179.992 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mp -72.67 -64.37 0.97 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.083 -1.011 . . . . 0.0 110.662 -179.988 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.57 ' HB2' HG22 ' A' ' 40' ' ' VAL . 15.1 m-70 -96.87 -28.01 14.42 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.141 -0.974 . . . . 0.0 110.653 -179.198 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.6 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.2 OUTLIER 76.08 26.53 0.98 Allowed 'General case' 0 N--CA 1.503 2.191 0 CA-C-O 121.599 0.714 . . . . 0.0 111.039 -179.929 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.57 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.0 m -113.91 166.93 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.035 -1.041 . . . . 0.0 109.848 178.63 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.8 p-10 -84.82 130.48 34.66 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.149 -0.969 . . . . 0.0 110.097 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -105.98 137.38 19.35 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.381 -0.825 . . . . 0.0 109.96 -179.554 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -63.57 145.53 91.85 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 122.237 1.958 . . . . 0.0 110.224 179.204 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.542 ' HB3' ' O ' ' A' ' 10' ' ' CYS . 1.7 pp -72.54 -4.23 29.35 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.206 -0.933 . . . . 0.0 110.943 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.64 -26.59 22.92 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.068 -1.02 . . . . 0.0 110.261 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -65.94 -26.37 67.56 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.899 -1.125 . . . . 0.0 109.685 179.17 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.02 165.68 24.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.182 -0.949 . . . . 0.0 109.687 179.475 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -127.96 -166.18 1.58 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.182 -0.949 . . . . 0.0 109.332 -179.938 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -46.83 -64.73 0.7 Allowed 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.315 -0.866 . . . . 0.0 109.958 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -117.74 -177.13 17.33 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.344 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.552 HG21 HG22 ' A' ' 16' ' ' THR . 5.3 mt -54.43 128.65 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.144 -1.21 . . . . 0.0 109.912 179.761 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.61 144.21 51.25 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.448 -0.782 . . . . 0.0 110.088 -179.933 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.16 160.92 41.28 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.373 -0.83 . . . . 0.0 109.549 178.959 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.67 -158.27 0.89 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.62 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -58.16 114.97 2.63 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.908 -1.12 . . . . 0.0 108.499 179.233 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 4.1 ttp180 -47.17 141.02 4.71 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.567 -0.708 . . . . 0.0 111.007 -178.622 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.495 1.801 0 O-C-N 121.585 -0.697 . . . . 0.0 109.74 179.754 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 1.733 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . 0.438 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 126.2 -12.49 7.16 Favored Glycine 0 N--CA 1.495 2.604 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 -179.333 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.512 HG23 ' CB ' ' A' ' 26' ' ' PRO . 17.4 m -54.4 100.58 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.025 -1.279 . . . . 0.0 108.942 179.188 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 4' ' ' GLY . 9.7 m -87.03 137.37 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 120.987 -1.071 . . . . 0.0 108.981 -179.454 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 31.9 t -67.02 117.57 9.26 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.335 -0.853 . . . . 0.0 110.583 -179.257 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.8 m -63.05 -7.61 5.8 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.381 -0.824 . . . . 0.0 110.545 178.913 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.429 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 1.2 m-80 -109.82 -28.14 8.94 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.93 -1.106 . . . . 0.0 111.177 -179.389 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.53 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 14.6 p -142.5 17.22 2.03 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 120.501 -1.375 . . . . 0.0 111.59 -179.813 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 47.64 26.3 0.82 Allowed 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.21 -0.931 . . . . 0.0 112.116 178.576 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.458 ' H ' ' HB3' ' A' ' 7' ' ' CYS . 3.3 t -90.11 128.7 36.38 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.582 -1.324 . . . . 0.0 109.521 179.147 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.48 -27.99 19.97 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.849 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -88.8 106.59 18.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.483 -0.761 . . . . 0.0 109.562 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.613 HG21 ' CH2' ' A' ' 18' ' ' TRP . 17.8 p -128.34 157.05 42.05 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.449 -0.782 . . . . 0.0 110.212 -179.69 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.566 HG22 HG21 ' A' ' 51' ' ' ILE . 40.8 p -86.31 -39.68 16.25 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.946 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.605 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 23.3 mt -138.04 102.27 4.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.435 -0.79 . . . . 0.0 109.417 179.638 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.613 ' CH2' HG21 ' A' ' 15' ' ' THR . 5.7 m95 -62.9 106.76 0.86 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.39 -0.819 . . . . 0.0 110.148 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -97.42 73.87 2.44 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.445 -0.785 . . . . 0.0 109.384 179.828 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.494 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -67.04 112.37 4.35 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.224 -0.922 . . . . 0.0 109.124 179.898 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.04 150.99 97.41 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.178 -0.951 . . . . 0.0 109.434 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -52.81 -41.06 72.69 Favored 'Trans proline' 0 C--N 1.317 -1.091 0 C-N-CA 122.486 2.124 . . . . 0.0 111.186 -179.147 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -25.29 50.22 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.264 -0.897 . . . . 0.0 110.06 179.331 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.5 44.43 0.84 Allowed Glycine 0 N--CA 1.497 2.746 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 179.767 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -128.08 98.74 26.3 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.326 -1.103 . . . . 0.0 110.46 -179.652 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.531 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.0 Cg_endo -66.5 94.91 0.32 Allowed 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.372 2.048 . . . . 0.0 109.998 178.811 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.534 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -114.08 123.71 70.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 120.961 -1.087 . . . . 0.0 110.406 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.6 p -48.42 132.8 16.67 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.64 -0.663 . . . . 0.0 109.379 179.338 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.605 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t-20 -40.44 -40.98 1.31 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.658 -0.652 . . . . 0.0 111.568 -177.943 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.58 -43.98 56.7 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.96 -1.088 . . . . 0.0 110.478 179.773 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.429 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 13.3 m -65.73 -39.2 90.89 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.314 -0.866 . . . . 0.0 109.265 179.445 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.14 -53.98 12.69 Favored Glycine 0 N--CA 1.496 2.697 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.634 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 48.0 mt -57.32 -57.2 13.66 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.341 -1.094 . . . . 0.0 109.941 -179.462 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.554 ' OH ' ' HD2' ' A' ' 42' ' ' ARG . 78.5 t80 -50.67 -43.97 57.61 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.583 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.617 ' O ' ' N ' ' A' ' 39' ' ' GLN . 27.4 t80 -57.57 -54.79 42.82 Favored 'General case' 0 C--O 1.195 -1.811 0 O-C-N 121.502 -0.749 . . . . 0.0 109.402 179.456 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -49.42 -34.35 16.24 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 119.932 -1.73 . . . . 0.0 111.096 179.781 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.413 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 9.6 mp -57.94 -65.12 0.69 Allowed 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.082 -1.011 . . . . 0.0 110.408 -179.638 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 -99.11 -33.15 10.9 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.256 -0.903 . . . . 0.0 109.03 179.549 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.617 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 73.2 47.99 0.18 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.868 0.842 . . . . 0.0 110.099 179.088 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 m -140.57 166.26 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 178.544 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -77.61 145.52 36.73 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.854 -1.154 . . . . 0.0 109.396 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.554 ' HD2' ' OH ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -146.22 150.23 40.77 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 120.918 -1.114 . . . . 0.0 110.125 -179.686 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.441 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 5.9 Cg_exo -57.18 147.43 76.09 Favored 'Trans proline' 0 C--N 1.314 -1.243 0 C-N-CA 122.227 1.952 . . . . 0.0 110.796 -179.947 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.547 HD23 ' H ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -86.59 23.93 1.54 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.498 -0.751 . . . . 0.0 110.591 179.993 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 70.5 p -68.67 -12.69 61.69 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.999 -1.063 . . . . 0.0 110.336 179.374 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -86.11 -31.27 21.97 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.252 -0.905 . . . . 0.0 110.303 -179.83 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.488 ' HG2' ' N ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -80.62 158.49 25.67 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.11 -0.994 . . . . 0.0 109.775 -179.814 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.488 ' N ' ' HG2' ' A' ' 47' ' ' ARG . 10.3 tttp -131.78 173.56 11.04 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.054 -1.029 . . . . 0.0 109.93 179.78 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.48 -37.72 77.38 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.354 -0.841 . . . . 0.0 109.586 179.854 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -97.63 132.32 10.93 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 179.158 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.566 HG21 HG22 ' A' ' 16' ' ' THR . 4.8 mt -53.47 104.04 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.387 -1.066 . . . . 0.0 109.912 -179.626 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . 0.475 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 1.9 mt-30 -46.5 96.76 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.009 0 O-C-N 122.047 -0.408 . . . . 0.0 111.041 -179.363 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 51' ' ' ILE . 0.3 OUTLIER -121.86 153.04 38.91 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.949 -1.094 . . . . 0.0 110.859 179.583 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.55 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 1.6 ptm180 -154.17 -154.45 0.52 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 115.541 -0.754 . . . . 0.0 108.971 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . 0.48 ' N ' ' HG3' ' A' ' 54' ' ' ARG . 23.7 t-20 -58.54 121.09 10.1 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 177.988 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -86.14 -169.43 2.64 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.419 -0.8 . . . . 0.0 111.083 -178.449 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER . . . . . 0 N--CA 1.493 1.696 0 O-C-N 121.305 -0.872 . . . . 0.0 109.645 179.904 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.497 1.923 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.9 -30.26 4.89 Favored Glycine 0 N--CA 1.496 2.682 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 -179.202 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . 0.623 HG23 ' HB2' ' A' ' 26' ' ' PRO . 4.9 m -72.18 88.93 1.15 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.266 -1.138 . . . . 0.0 109.472 179.505 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 6' ' ' VAL . 15.9 m -78.73 120.19 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.124 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.562 ' HB2' HG22 ' A' ' 12' ' ' THR . 45.3 t -49.42 112.78 0.69 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.191 -0.943 . . . . 0.0 110.585 -178.411 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 71.0 m -57.19 -16.97 9.29 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.412 -0.805 . . . . 0.0 110.839 179.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . 0.472 ' CB ' ' SG ' ' A' ' 31' ' ' CYS . 25.3 m-20 -98.87 -31.01 12.07 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.002 -1.061 . . . . 0.0 111.437 -179.206 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 19.1 p -138.73 22.02 2.68 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.468 -1.395 . . . . 0.0 111.474 179.294 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.481 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER 44.59 21.02 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.303 -0.873 . . . . 0.0 112.692 178.851 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.562 HG22 ' HB2' ' A' ' 7' ' ' CYS . 6.1 t -80.78 130.48 35.09 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.579 -1.325 . . . . 0.0 109.749 179.927 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.0 p -90.47 -4.93 56.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.29 -0.881 . . . . 0.0 109.42 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.418 ' HB ' HG13 ' A' ' 51' ' ' ILE . 31.9 p -118.65 121.45 40.18 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -0.947 . . . . 0.0 110.085 -179.616 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.603 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 21.5 p -143.58 160.88 39.85 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.323 -0.861 . . . . 0.0 110.117 179.475 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 21.3 p -81.52 -47.45 13.1 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.877 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.545 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 10.9 mt -130.94 109.92 10.89 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.686 -0.633 . . . . 0.0 109.37 179.206 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.603 ' CZ2' HG23 ' A' ' 15' ' ' THR . 16.7 m95 -79.34 85.83 5.13 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.577 -0.702 . . . . 0.0 109.79 -179.615 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . 0.598 ' HD3' ' HA ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -77.57 93.64 4.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.073 -1.017 . . . . 0.0 109.335 179.556 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.477 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -68.06 124.21 22.77 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.33 -0.856 . . . . 0.0 110.149 -179.27 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -81.26 141.17 49.46 Favored Pre-proline 0 N--CA 1.499 1.989 0 O-C-N 121.361 -0.837 . . . . 0.0 109.559 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -54.36 -41.17 78.91 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 122.515 2.144 . . . . 0.0 110.933 -179.766 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.3 mtp -59.78 -20.44 56.74 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.32 -0.863 . . . . 0.0 109.95 179.386 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.54 39.66 1.44 Allowed Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 179.827 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -127.6 91.19 46.3 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.379 -1.071 . . . . 0.0 110.146 -179.818 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.623 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.6 Cg_endo -64.36 100.3 0.32 Allowed 'Trans proline' 0 C--N 1.311 -1.424 0 C-N-CA 122.203 1.935 . . . . 0.0 109.524 179.064 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.463 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.0 m -109.12 153.88 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 120.869 -1.144 . . . . 0.0 110.998 -179.476 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.507 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 16.0 p -81.8 138.88 35.06 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.598 ' HA ' ' HD3' ' A' ' 19' ' ' ARG . 6.0 t-20 -38.12 -36.64 0.22 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.781 -0.575 . . . . 0.0 111.812 -178.64 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.69 -43.07 81.01 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.271 -0.893 . . . . 0.0 111.76 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.472 ' SG ' ' CB ' ' A' ' 9' ' ' ASN . 1.8 m -57.98 -41.01 82.07 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.001 -1.062 . . . . 0.0 109.621 -179.671 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . 0.455 ' HA3' ' CZ ' ' A' ' 19' ' ' ARG . . . -74.02 -39.59 45.46 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 -179.925 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.5 HD23 ' HA ' ' A' ' 33' ' ' LEU . 25.0 mt -64.65 -65.15 0.71 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.484 -1.01 . . . . 0.0 110.26 -179.616 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.792 ' HA ' HD22 ' A' ' 37' ' ' LEU . 23.3 t80 -51.74 -39.98 59.44 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.233 -0.917 . . . . 0.0 108.843 179.77 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.485 ' O ' ' N ' ' A' ' 39' ' ' GLN . 60.2 t80 -53.59 -47.81 69.81 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.564 -0.71 . . . . 0.0 109.633 179.198 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -66.99 -38.67 86.44 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.208 -0.933 . . . . 0.0 110.14 -179.902 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.792 HD22 ' HA ' ' A' ' 34' ' ' TYR . 0.4 OUTLIER -45.27 -53.21 8.67 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.293 -0.879 . . . . 0.0 110.031 -179.564 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.543 ' CB ' HG22 ' A' ' 40' ' ' VAL . 37.6 m-70 -111.53 6.37 20.07 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.351 -0.843 . . . . 0.0 109.549 179.156 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 35' ' ' TYR . 3.2 tp-100 49.22 32.67 4.42 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.431 -0.793 . . . . 0.0 110.133 -178.751 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.543 HG22 ' CB ' ' A' ' 38' ' ' HIS . 4.0 m -134.08 -174.44 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.503 -0.748 . . . . 0.0 109.558 179.826 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -61.97 172.5 1.35 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.237 -0.915 . . . . 0.0 110.319 179.574 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.597 ' HB3' ' CD1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -133.36 131.38 21.51 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.24 -0.912 . . . . 0.0 109.451 -179.867 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.24 112.93 1.85 Allowed 'Trans proline' 0 C--N 1.315 -1.218 0 C-N-CA 122.135 1.89 . . . . 0.0 110.335 179.857 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -72.74 -7.24 49.61 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.21 -0.931 . . . . 0.0 110.378 179.779 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 75.0 p -54.42 -20.66 7.9 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.05 -1.031 . . . . 0.0 110.003 178.631 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.03 -15.36 62.55 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.139 -0.975 . . . . 0.0 110.725 179.627 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 12.0 mmm180 -56.56 148.03 20.69 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 120.719 -1.238 . . . . 0.0 110.24 -179.785 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.85 -162.92 1.27 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.42 -0.8 . . . . 0.0 109.852 -179.916 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -79.99 -41.17 26.4 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.12 -0.988 . . . . 0.0 109.884 179.982 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -133.15 165.89 23.88 Favored Glycine 0 N--CA 1.498 2.793 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.418 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.4 mt -56.59 125.87 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.195 -1.18 . . . . 0.0 109.973 179.87 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.63 154.53 32.58 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.561 -0.712 . . . . 0.0 109.589 179.247 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.84 165.32 36.83 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.977 -1.077 . . . . 0.0 109.252 179.1 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.435 HH11 ' CG ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -150.46 -172.68 4.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.539 -0.725 . . . . 0.0 109.382 -179.421 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -51.69 118.69 3.55 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.106 -0.996 . . . . 0.0 108.718 179.228 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -47.43 140.58 5.62 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.581 -0.7 . . . . 0.0 110.351 -178.985 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.2 ttmt . . . . . 0 N--CA 1.497 1.891 0 O-C-N 121.581 -0.699 . . . . 0.0 110.149 -179.742 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.495 1.812 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.3 -23.83 5.41 Favored Glycine 0 N--CA 1.496 2.649 0 N-CA-C 109.266 -1.534 . . . . 0.0 109.266 -178.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.0 m -69.13 93.36 0.59 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.31 -1.112 . . . . 0.0 109.843 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.68 129.74 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 178.41 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' CYS . . . . . 0.508 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 6.9 t -45.13 111.98 0.39 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.523 -0.736 . . . . 0.0 111.132 -178.638 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -60.58 -13.32 13.53 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.25 -0.906 . . . . 0.0 110.671 179.679 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -105.03 -28.59 10.96 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.776 -1.203 . . . . 0.0 111.589 -179.309 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' CYS . . . . . 0.623 ' SG ' ' HD2' ' A' ' 47' ' ' ARG . 9.4 p -138.71 24.7 2.62 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.637 -1.289 . . . . 0.0 110.59 179.005 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 1.3 pt20 38.45 25.98 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 179.132 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' THR . . . . . 0.466 HG22 ' HB2' ' A' ' 7' ' ' CYS . 3.8 t -90.1 124.18 34.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.589 -1.319 . . . . 0.0 109.816 179.228 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.07 -23.96 21.28 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.447 -0.783 . . . . 0.0 109.711 -179.867 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . 0.513 ' HB ' HG13 ' A' ' 51' ' ' ILE . 2.9 p -89.86 94.13 9.7 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.225 -0.922 . . . . 0.0 109.173 179.807 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' THR . . . . . 0.544 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 5.2 p -117.71 149.59 40.5 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.269 -0.895 . . . . 0.0 110.059 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' THR . . . . . 0.513 HG22 HG21 ' A' ' 51' ' ' ILE . 30.7 p -74.04 -33.72 63.83 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 179.145 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' LEU . . . . . 0.423 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 73.3 mt -146.32 108.52 4.42 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.34 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' TRP . . . . . 0.544 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.6 m95 -65.39 86.33 0.07 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.382 -0.824 . . . . 0.0 109.696 -179.774 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -76.98 80.25 3.52 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.433 -0.792 . . . . 0.0 109.381 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ARG . . . . . 0.486 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -57.91 123.45 15.84 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.364 -0.835 . . . . 0.0 109.594 -179.832 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 t -78.58 145.99 68.53 Favored Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.346 -0.846 . . . . 0.0 109.912 -179.599 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -58.76 -23.17 65.28 Favored 'Trans proline' 0 C--N 1.319 -1.024 0 C-N-CA 122.443 2.095 . . . . 0.0 110.482 179.185 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.04 1.28 21.47 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.207 -0.933 . . . . 0.0 110.307 179.309 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.85 29.89 16.72 Favored Glycine 0 N--CA 1.497 2.741 0 N-CA-C 109.412 -1.475 . . . . 0.0 109.412 -179.562 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -121.34 101.03 44.4 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.406 -1.055 . . . . 0.0 110.339 -179.419 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 3.2 Cg_exo -63.11 99.69 0.23 Allowed 'Trans proline' 0 C--N 1.311 -1.417 0 C-N-CA 121.997 1.798 . . . . 0.0 109.605 178.48 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.508 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 1.6 m -110.34 154.56 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 CA-C-O 122.292 1.044 . . . . 0.0 111.024 -179.77 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.405 ' O ' ' C ' ' A' ' 29' ' ' ASN . 15.7 p -81.14 138.37 35.9 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.689 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' ASN . . . . . 0.423 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 3.5 t-20 -35.22 -46.8 0.37 Allowed 'General case' 0 N--CA 1.504 2.275 0 O-C-N 121.657 -0.652 . . . . 0.0 112.093 -178.551 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . 0.437 ' HB3' HH12 ' A' ' 47' ' ' ARG . . . -55.15 -47.26 75.37 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.377 -0.827 . . . . 0.0 111.472 -179.339 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 3.4 m -57.19 -38.66 73.98 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.091 -1.006 . . . . 0.0 109.81 179.966 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -72.92 -36.52 57.36 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.991 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 37' ' ' LEU . 81.0 mt -73.15 -66.22 0.71 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.432 -1.04 . . . . 0.0 110.09 -179.851 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' TYR . . . . . 0.464 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 80.2 t80 -46.34 -34.46 4.58 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.357 -0.839 . . . . 0.0 109.173 179.655 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' TYR . . . . . 0.632 ' O ' ' N ' ' A' ' 39' ' ' GLN . 30.5 t80 -63.47 -62.58 1.58 Allowed 'General case' 0 C--O 1.193 -1.886 0 O-C-N 121.285 -0.885 . . . . 0.0 109.009 178.746 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 tttm -48.06 -30.41 4.41 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 120.084 -1.635 . . . . 0.0 110.799 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.507 HD13 ' O ' ' A' ' 33' ' ' LEU . 9.6 mp -57.33 -69.52 0.16 Allowed 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.198 -0.939 . . . . 0.0 109.971 179.734 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' HIS . . . . . 0.543 ' HB2' HG22 ' A' ' 40' ' ' VAL . 17.6 m-70 -99.38 -28.74 13.14 Favored 'General case' 0 N--CA 1.506 2.34 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.039 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.632 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.9 OUTLIER 76.19 49.0 0.07 Allowed 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 122.059 0.933 . . . . 0.0 110.346 179.21 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' VAL . . . . . 0.543 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.8 m -133.44 -178.87 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.558 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -59.1 161.05 5.53 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.641 -1.287 . . . . 0.0 110.022 179.779 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' ARG . . . . . 0.499 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -127.21 106.69 21.69 Favored Pre-proline 0 N--CA 1.498 1.962 0 O-C-N 121.041 -1.037 . . . . 0.0 109.759 -179.12 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.16 141.93 90.08 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 122.353 2.035 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' LEU . . . . . 0.643 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -84.8 5.52 28.3 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.257 -0.902 . . . . 0.0 110.785 179.953 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 54.6 p -61.24 -26.7 67.93 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.461 -1.399 . . . . 0.0 109.696 179.054 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.65 4.19 33.57 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.133 -0.979 . . . . 0.0 110.821 179.79 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' ARG . . . . . 0.623 ' HD2' ' SG ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -82.35 -174.9 5.41 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.567 -1.333 . . . . 0.0 109.621 179.636 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -151.43 156.9 41.59 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.124 -0.985 . . . . 0.0 109.416 179.793 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -55.03 -35.2 64.19 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.295 -0.878 . . . . 0.0 109.792 179.878 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.88 146.92 16.63 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 109.071 -1.612 . . . . 0.0 109.071 179.033 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' ILE . . . . . 0.513 HG13 ' HB ' ' A' ' 14' ' ' THR . 6.0 mt -50.22 120.62 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.345 -1.091 . . . . 0.0 109.852 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.79 151.57 33.81 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.404 -0.81 . . . . 0.0 109.563 179.814 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' THR . . . . . 0.431 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -155.49 165.04 37.82 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.266 -0.896 . . . . 0.0 109.419 179.445 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' ARG . . . . . 0.482 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 2.1 mtm-85 -145.64 -152.49 0.43 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.625 -0.672 . . . . 0.0 109.709 -179.5 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.58 122.56 16.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.112 -0.993 . . . . 0.0 109.105 179.324 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.06 112.82 0.48 Allowed 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.446 0.641 . . . . 0.0 110.752 -179.171 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.491 1.608 0 O-C-N 121.389 -0.819 . . . . 0.0 109.287 179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.54 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.61 1.674 0 O4'-C1'-N19 110.345 3.182 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.54 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.732 1 O4'-C1'-N19 111.414 4.518 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.583 ' H61' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.527 2.062 0 O4'-C1'-N19 110.723 3.654 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.583 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.01 0 O4'-C1'-N19 110.65 3.563 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.536 H2'' ' C8 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.824 0 O4'-C1'-N19 110.717 3.646 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.536 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.012 0 O4'-C1'-N19 110.755 3.694 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.457 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.825 1 O4'-C1'-N19 111.281 4.351 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.457 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.806 0 C3'-C2'-C1' 107.198 3.213 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.679 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.792 0 O4'-C1'-N19 110.865 3.831 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.679 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.227 1 O4'-C1'-N19 111.827 5.033 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.611 ' P ' HD23 ' A' ' 37' ' ' LEU . . . . . . . . 0 C5'--C4' 1.527 2.028 1 O4'-C1'-N19 111.081 4.101 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.57 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 P--O5' 1.611 1.763 0 O4'-C1'-N19 110.6 3.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.681 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.477 1 O4'-C1'-N19 111.082 4.102 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.529 ' H71' " H2'" ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.564 1 O4'-C1'-N19 111.856 5.07 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.48 " H2'" ' H71' ' C' ' 127' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.497 0 O4'-C1'-N19 110.946 3.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.48 ' H71' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.959 1 O4'-C1'-N19 111.086 4.108 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.499 2.011 0 CA-C-O 120.745 0.307 . . . . 0.0 110.321 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -64.28 -31.69 72.99 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.085 -1.009 . . . . 0.0 110.092 179.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -51.91 138.6 24.1 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.299 -0.876 . . . . 0.0 109.619 179.61 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.32 -31.77 7.8 Favored Glycine 0 N--CA 1.494 2.549 0 N-CA-C 109.194 -1.562 . . . . 0.0 109.194 -179.037 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.603 HG23 ' HB2' ' A' ' 26' ' ' PRO . 3.5 m -63.5 91.69 0.06 Allowed 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.343 -1.092 . . . . 0.0 109.137 178.984 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 m -88.93 122.17 39.95 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.749 0 N-CA-C 108.017 -1.105 . . . . 0.0 108.017 179.578 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.516 ' CB ' HG22 ' A' ' 12' ' ' THR . 49.5 t -49.57 118.06 2.57 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 121.336 -0.853 . . . . 0.0 110.602 -178.662 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 28.1 m -65.33 -7.71 14.81 Favored 'General case' 0 N--CA 1.499 1.994 0 O-C-N 121.411 -0.806 . . . . 0.0 111.115 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.63 ' OD1' HG11 ' A' ' 27' ' ' VAL . 6.8 m120 -107.78 -23.64 12.0 Favored 'General case' 0 N--CA 1.498 1.925 0 O-C-N 120.732 -1.23 . . . . 0.0 110.858 179.943 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.534 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 14.0 p -145.41 20.63 1.53 Allowed 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.669 -1.269 . . . . 0.0 111.176 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.487 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER 45.05 20.31 0.04 OUTLIER 'General case' 0 N--CA 1.508 2.451 0 N-CA-C 112.945 0.72 . . . . 0.0 112.945 178.71 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.516 HG22 ' CB ' ' A' ' 7' ' ' CYS . 14.1 t -77.4 135.78 38.35 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.34 -1.475 . . . . 0.0 109.655 179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.3 p -95.0 -21.37 18.64 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.536 -0.728 . . . . 0.0 109.347 179.487 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.505 ' HB ' HG13 ' A' ' 51' ' ' ILE . 72.3 p -109.45 120.31 42.1 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.249 -0.907 . . . . 0.0 109.772 -179.968 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.584 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 4.4 p -135.71 159.77 40.62 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.279 -0.888 . . . . 0.0 109.591 179.366 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.681 HG21 " H3'" ' C' ' 124' ' ' ' DA' . 6.0 p -83.54 -30.77 26.81 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.562 -0.711 . . . . 0.0 109.205 179.737 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.61 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 45.9 mt -142.13 91.3 2.33 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.345 -0.847 . . . . 0.0 109.371 179.504 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.568 ' CZ2' HG23 ' A' ' 15' ' ' THR . 18.5 m95 -64.2 109.1 1.75 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.296 -0.877 . . . . 0.0 109.806 -179.975 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.566 ' HG3' ' O ' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -98.85 130.32 45.26 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.224 -0.922 . . . . 0.0 109.403 179.651 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 4.8 mmm180 -96.38 119.8 35.52 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.16 -0.963 . . . . 0.0 109.745 -179.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.6 t -79.21 142.8 59.56 Favored Pre-proline 0 N--CA 1.499 2.018 0 O-C-N 121.206 -0.934 . . . . 0.0 109.478 179.689 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.2 Cg_exo -54.32 -41.61 74.87 Favored 'Trans proline' 0 C--N 1.32 -0.959 0 C-N-CA 122.655 2.237 . . . . 0.0 111.0 -179.638 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.7 mtm -62.05 -21.06 64.61 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.268 -0.895 . . . . 0.0 109.412 179.195 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.02 44.66 1.08 Allowed Glycine 0 N--CA 1.497 2.753 0 N-CA-C 109.77 -1.332 . . . . 0.0 109.77 179.811 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 29.1 m-20 -129.28 98.94 22.14 Favored Pre-proline 0 N--CA 1.496 1.848 0 O-C-N 121.155 -1.203 . . . . 0.0 110.822 -179.394 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.603 ' HB2' HG23 ' A' ' 5' ' ' THR . 1.8 Cg_endo -65.97 107.09 1.06 Allowed 'Trans proline' 0 C--N 1.314 -1.247 0 C-N-CA 122.101 1.867 . . . . 0.0 109.241 178.244 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.63 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.0 m -122.88 126.28 73.56 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.087 0 O-C-N 121.135 -0.978 . . . . 0.0 110.506 -179.596 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.584 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.2 p -48.06 131.12 15.87 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.404 -0.81 . . . . 0.0 109.839 179.736 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.61 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 5.6 t-20 -35.09 -43.68 0.21 Allowed 'General case' 0 N--CA 1.508 2.451 0 O-C-N 121.837 -0.54 . . . . 0.0 112.156 -178.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.462 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -51.43 -45.42 62.63 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.276 -0.89 . . . . 0.0 110.606 -179.664 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.475 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 18.6 m -64.75 -37.44 87.59 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.331 -0.856 . . . . 0.0 108.999 179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.29 -53.53 25.05 Favored Glycine 0 N--CA 1.495 2.602 0 N-CA-C 110.045 -1.222 . . . . 0.0 110.045 179.843 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.529 ' O ' HD13 ' A' ' 37' ' ' LEU . 93.7 mt -55.74 -58.44 7.81 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.503 -0.998 . . . . 0.0 109.877 -179.874 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.691 ' HA ' HD22 ' A' ' 37' ' ' LEU . 11.4 t80 -47.28 -42.62 21.24 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.489 -0.757 . . . . 0.0 109.749 179.829 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.417 ' O ' ' N ' ' A' ' 39' ' ' GLN . 40.4 t80 -52.29 -46.99 66.13 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.374 -0.829 . . . . 0.0 109.979 179.77 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -69.4 -38.1 77.8 Favored 'General case' 0 N--CA 1.502 2.134 0 O-C-N 120.82 -1.175 . . . . 0.0 110.206 179.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.691 HD22 ' HA ' ' A' ' 34' ' ' TYR . 6.0 mp -42.97 -52.46 5.19 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.565 -0.709 . . . . 0.0 110.16 -179.326 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.465 ' CB ' HG22 ' A' ' 40' ' ' VAL . 78.6 m-70 -121.37 12.13 10.84 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.18 -0.95 . . . . 0.0 110.082 178.977 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.417 ' N ' ' O ' ' A' ' 35' ' ' TYR . 8.4 tt0 50.13 34.92 9.13 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.356 -0.84 . . . . 0.0 110.141 -179.384 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.465 HG22 ' CB ' ' A' ' 38' ' ' HIS . 2.9 m -135.96 -165.42 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.206 0 O-C-N 121.313 -0.867 . . . . 0.0 109.203 179.749 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 28.7 p30 -62.93 -173.82 0.06 Allowed 'General case' 0 N--CA 1.496 1.847 0 O-C-N 121.224 -0.922 . . . . 0.0 110.254 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.475 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -146.41 106.97 4.11 Favored Pre-proline 0 N--CA 1.493 1.704 0 O-C-N 121.283 -0.885 . . . . 0.0 109.884 -179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.511 ' HD2' ' CZ ' ' A' ' 34' ' ' TYR . 3.5 Cg_exo -60.34 128.01 24.8 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 C-N-CA 122.234 1.956 . . . . 0.0 110.08 179.733 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.672 HD23 ' H ' ' A' ' 44' ' ' LEU . 0.9 OUTLIER -93.3 25.48 3.34 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.335 -0.853 . . . . 0.0 110.884 -179.299 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -68.81 -6.91 29.67 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.031 -1.043 . . . . 0.0 110.849 179.578 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 57.8 mtm -102.93 -7.82 21.19 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 120.871 -1.143 . . . . 0.0 110.61 179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.518 ' HG3' ' NH1' ' A' ' 47' ' ' ARG . 0.0 OUTLIER -81.64 164.76 21.61 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 120.869 -1.144 . . . . 0.0 110.451 -179.678 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -147.2 -169.12 3.23 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.365 -0.835 . . . . 0.0 109.719 -179.888 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.4 p-10 -78.84 -9.53 59.5 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.093 -1.004 . . . . 0.0 110.699 179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -137.17 145.08 16.8 Favored Glycine 0 N--CA 1.499 2.882 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 179.768 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.505 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.1 mt -54.18 124.3 6.59 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.405 -1.056 . . . . 0.0 110.108 -179.957 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -72.49 159.59 33.69 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.451 -0.781 . . . . 0.0 109.4 179.329 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.32 163.34 40.25 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.011 -1.055 . . . . 0.0 109.378 179.556 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 10.2 mmm180 -149.86 -163.26 1.74 Allowed 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 109.005 -0.739 . . . . 0.0 109.005 -179.436 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -61.4 93.93 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.042 -1.036 . . . . 0.0 108.515 179.091 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.36 150.19 1.36 Allowed 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.566 -0.709 . . . . 0.0 109.972 -179.317 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt -51.55 126.03 16.3 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.358 -0.839 . . . . 0.0 109.641 179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.2 p -43.99 129.22 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.999 0 O-C-N 121.711 -0.618 . . . . 0.0 110.465 -179.531 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -73.47 65.93 0.95 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 179.159 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 30.6 t . . . . . 0 N--CA 1.498 1.929 0 O-C-N 121.157 -0.964 . . . . 0.0 109.071 -179.702 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.517 ' C6 ' ' C6 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.667 0 O4'-C1'-N19 110.75 3.688 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.517 ' C6 ' ' C6 ' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.74 1 O4'-C1'-N19 111.584 4.73 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.404 " O5'" H2'' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.353 1 O4'-C1'-N19 111.012 4.014 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.518 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.406 1 O4'-C1'-N19 111.472 4.59 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.518 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C1'-N19 110.504 3.381 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.648 0 O4'-C1'-N19 110.759 3.699 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.441 1.598 1 O4'-C1'-N19 111.361 4.451 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.409 " H5'" ' CZ ' ' A' ' 54' ' ' ARG . . . . . . . . 0 O4'--C1' 1.442 1.711 0 O4'-C1'-N19 110.755 3.694 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.611 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.987 0 O4'-C1'-N19 110.823 3.778 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.611 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.58 1 O4'-C1'-N19 111.938 5.173 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.598 ' H71' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.564 1 O4'-C1'-N19 111.148 4.185 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.527 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 P--O5' 1.612 1.872 0 O4'-C1'-N19 110.501 3.376 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.832 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.355 0 O4'-C1'-N19 110.499 3.374 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.641 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.528 2.178 1 O4'-C1'-N19 112.356 5.696 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.49 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.705 0 O4'-C1'-N19 110.916 3.895 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.401 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.781 0 O4'-C1'-N19 110.686 3.608 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.97 0 N-CA-C 111.389 0.144 . . . . 0.0 111.389 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.0 tpt180 -86.58 62.06 7.19 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 120.499 -1.376 . . . . 0.0 109.971 -179.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.78 123.67 18.18 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.201 -0.937 . . . . 0.0 109.054 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 130.44 -30.44 3.45 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 109.369 -1.493 . . . . 0.0 109.369 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.471 HG22 ' CH2' ' A' ' 18' ' ' TRP . 72.8 m -72.09 86.15 1.04 Allowed 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.088 -1.242 . . . . 0.0 109.316 179.27 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.497 HG23 ' O ' ' A' ' 6' ' ' VAL . 28.3 m -88.46 112.81 24.37 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 N-CA-C 107.879 -1.156 . . . . 0.0 107.879 179.177 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.528 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 52.9 t -47.99 108.05 0.15 Allowed 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.466 -0.771 . . . . 0.0 110.732 -178.43 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.9 m -59.76 -14.96 16.84 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.309 -0.869 . . . . 0.0 111.129 -179.739 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.539 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.9 OUTLIER -90.36 -30.11 17.63 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.032 -1.043 . . . . 0.0 110.739 -179.788 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.788 ' HA ' HD22 ' A' ' 44' ' ' LEU . 16.3 p -143.25 23.81 1.82 Allowed 'General case' 0 N--CA 1.501 2.088 0 O-C-N 120.627 -1.296 . . . . 0.0 110.908 179.868 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.469 ' N ' ' O ' ' A' ' 7' ' ' CYS . 7.1 mt-30 44.61 22.56 0.06 Allowed 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.354 -0.842 . . . . 0.0 112.201 179.362 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.604 HG22 ' SG ' ' A' ' 10' ' ' CYS . 6.7 t -89.19 125.63 35.15 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 120.515 -1.366 . . . . 0.0 110.051 179.879 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 9.6 t -90.96 -17.11 26.91 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.638 -0.664 . . . . 0.0 109.639 179.847 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.529 ' HB ' HG13 ' A' ' 51' ' ' ILE . 23.0 p -101.42 115.63 30.93 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.252 -0.905 . . . . 0.0 109.035 179.577 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.529 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 6.9 p -135.44 153.17 51.86 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.218 -0.926 . . . . 0.0 110.211 179.752 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.832 HG21 " H3'" ' C' ' 124' ' ' ' DA' . 40.7 p -83.43 -34.74 25.4 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.53 -0.915 . . . . 0.0 108.53 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.575 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 35.4 mt -137.61 96.96 3.34 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.475 -0.766 . . . . 0.0 109.312 179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.529 ' CZ3' HG21 ' A' ' 15' ' ' THR . 8.6 m95 -62.93 110.96 1.95 Allowed 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.153 -0.967 . . . . 0.0 109.843 -179.793 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -107.34 104.51 14.13 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 121.358 -0.839 . . . . 0.0 109.237 179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.456 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -73.21 115.14 12.19 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.944 -1.098 . . . . 0.0 108.812 179.784 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.537 ' HB3' ' HG2' ' A' ' 23' ' ' MET . 0.2 OUTLIER -67.95 144.49 97.2 Favored Pre-proline 0 N--CA 1.5 2.064 0 O-C-N 121.21 -0.931 . . . . 0.0 110.293 -179.118 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -55.18 -40.84 83.68 Favored 'Trans proline' 0 C--N 1.319 -1.013 0 C-N-CA 122.867 2.378 . . . . 0.0 110.952 -179.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.537 ' HG2' ' HB3' ' A' ' 21' ' ' SER . 1.4 ptt? -54.73 -23.8 19.34 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.401 -0.812 . . . . 0.0 109.986 179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.57 37.18 1.47 Allowed Glycine 0 N--CA 1.497 2.713 0 N-CA-C 109.935 -1.266 . . . . 0.0 109.935 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -136.23 116.19 11.13 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 120.864 -1.374 . . . . 0.0 110.322 -179.865 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.456 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 5.1 Cg_exo -62.06 106.13 0.44 Allowed 'Trans proline' 0 C--N 1.316 -1.177 0 C-N-CA 122.321 2.014 . . . . 0.0 110.026 178.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.528 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.8 m -120.37 126.01 74.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.748 0 O-C-N 121.104 -0.997 . . . . 0.0 110.665 -179.713 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.408 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 9.7 p -49.27 133.67 19.13 Favored 'General case' 0 C--N 1.307 -1.272 0 CA-C-O 121.443 0.64 . . . . 0.0 109.456 179.422 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.575 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 8.1 t-20 -37.9 -45.43 0.86 Allowed 'General case' 0 N--CA 1.507 2.4 0 O-C-N 121.578 -0.701 . . . . 0.0 111.577 -178.961 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.71 -46.49 40.77 Favored 'General case' 0 N--CA 1.504 2.259 0 O-C-N 121.208 -0.933 . . . . 0.0 110.96 -179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.539 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 6.9 m -60.24 -47.05 87.62 Favored 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 179.006 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -57.44 -32.44 64.38 Favored Glycine 0 N--CA 1.494 2.52 0 N-CA-C 109.626 -1.389 . . . . 0.0 109.626 178.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.537 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 81.9 mt -75.85 -64.01 1.18 Allowed 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.512 -0.993 . . . . 0.0 109.284 179.553 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.487 ' HA ' HD22 ' A' ' 37' ' ' LEU . 9.3 t80 -47.13 -38.71 12.02 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.055 -1.028 . . . . 0.0 109.143 179.166 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.438 ' O ' ' N ' ' A' ' 39' ' ' GLN . 31.5 t80 -60.18 -49.54 77.23 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.48 -0.763 . . . . 0.0 109.787 179.198 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.537 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -62.06 -25.5 67.72 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.671 -1.268 . . . . 0.0 110.671 -179.921 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.487 HD22 ' HA ' ' A' ' 34' ' ' TYR . 6.5 mp -62.19 -63.75 1.14 Allowed 'General case' 0 N--CA 1.503 2.177 0 O-C-N 121.206 -0.934 . . . . 0.0 110.268 -179.863 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.529 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 69.8 m-70 -106.93 13.47 27.63 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.322 -0.862 . . . . 0.0 110.366 -179.725 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.529 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER 42.98 33.02 0.46 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.679 -0.638 . . . . 0.0 111.219 -179.557 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.507 HG22 ' O ' ' A' ' 38' ' ' HIS . 5.4 m -136.01 164.72 31.28 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 O-C-N 121.15 -0.969 . . . . 0.0 110.176 -179.791 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.1 p-10 -84.45 136.31 33.9 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.438 -0.789 . . . . 0.0 108.974 179.096 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.4 ' HA ' ' HD3' ' A' ' 43' ' ' PRO . 2.5 mpt_? -131.78 148.07 68.5 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 121.273 -0.892 . . . . 0.0 109.994 -179.774 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.4 ' HD3' ' HA ' ' A' ' 42' ' ' ARG . 1.7 Cg_endo -63.02 144.33 92.67 Favored 'Trans proline' 0 C--N 1.314 -1.249 0 C-N-CA 122.44 2.093 . . . . 0.0 111.011 -179.848 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.788 HD22 ' HA ' ' A' ' 10' ' ' CYS . 0.5 OUTLIER -84.49 41.63 0.85 Allowed 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.503 -0.748 . . . . 0.0 110.709 179.967 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 17.4 p -63.78 -17.32 62.95 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.136 -0.977 . . . . 0.0 110.373 179.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 32.6 ttp -97.45 -2.12 42.78 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.122 -0.986 . . . . 0.0 110.609 179.709 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.451 ' HB2' ' HB2' ' A' ' 44' ' ' LEU . 1.8 tpt180 -63.64 145.04 56.49 Favored 'General case' 0 N--CA 1.503 2.187 0 O-C-N 120.645 -1.285 . . . . 0.0 110.486 -179.707 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -112.97 -176.27 2.86 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.405 -0.809 . . . . 0.0 109.943 -179.976 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.8 t0 -78.45 -40.7 34.92 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.633 -0.667 . . . . 0.0 110.177 -179.71 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.43 165.76 19.49 Favored Glycine 0 N--CA 1.5 2.937 0 N-CA-C 110.39 -1.084 . . . . 0.0 110.39 -179.697 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.636 HG21 HG22 ' A' ' 16' ' ' THR . 5.8 mt -58.13 123.78 10.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.52 -0.988 . . . . 0.0 110.217 -179.967 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -75.86 159.29 31.12 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.556 -0.715 . . . . 0.0 109.856 179.608 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.98 162.91 40.28 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.272 -0.892 . . . . 0.0 109.275 179.079 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.415 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.1 OUTLIER -150.59 -161.82 1.42 Allowed 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.703 -0.623 . . . . 0.0 109.323 -179.685 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -62.74 91.83 0.04 OUTLIER 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.003 -1.061 . . . . 0.0 108.716 179.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -48.43 130.69 16.87 Favored 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.602 -0.686 . . . . 0.0 110.215 -178.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -54.35 132.61 44.37 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.504 -0.748 . . . . 0.0 110.008 -179.735 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.412 HG12 ' N ' ' A' ' 59' ' ' SER . 44.1 t -85.02 160.46 3.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.636 0 O-C-N 121.501 -0.749 . . . . 0.0 109.133 179.462 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.412 ' N ' HG12 ' A' ' 58' ' ' VAL . 7.9 t -53.59 108.72 0.37 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.208 -0.932 . . . . 0.0 109.865 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER . . . . . 0 N--CA 1.499 2.018 0 O-C-N 121.622 -0.674 . . . . 0.0 109.98 -179.721 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.557 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.444 1.82 0 O4'-C1'-N19 110.361 3.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.682 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.525 1.716 1 O4'-C1'-N19 111.408 4.51 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.62 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.827 0 O4'-C1'-N19 110.847 3.808 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.62 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.685 1 O4'-C1'-N19 111.089 4.111 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.528 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.797 0 O4'-C1'-N19 110.832 3.79 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.484 " O5'" H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.441 1.597 0 O4'-C1'-N19 110.796 3.745 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.437 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.566 1 O4'-C1'-N19 111.365 4.456 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.76 0 O4'-C1'-N19 110.634 3.543 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.638 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.651 1 O4'-C1'-N19 111.677 4.846 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.638 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.468 1 O4'-C1'-N19 111.926 5.158 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.452 ' C5 ' ' C2 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.802 1 O4'-C1'-N19 111.475 4.594 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.497 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.416 0 O4'-C1'-N19 110.582 3.477 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.541 " H2'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.51 0 O4'-C1'-N19 110.973 3.966 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.723 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.466 1 O4'-C1'-N19 112.127 5.409 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.547 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.186 0 O4'-C1'-N19 110.969 3.962 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.45 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.532 2.649 0 O4'-C1'-N19 110.813 3.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 13.8 mtmt . . . . . 0 N--CA 1.497 1.921 0 N-CA-C 109.587 -0.523 . . . . 0.0 109.587 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -98.06 59.57 1.41 Allowed 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.139 -0.976 . . . . 0.0 109.804 -179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.31 124.62 18.65 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.335 -0.853 . . . . 0.0 109.214 179.606 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.84 -45.7 1.14 Allowed Glycine 0 N--CA 1.494 2.563 0 N-CA-C 109.304 -1.518 . . . . 0.0 109.304 -179.213 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.432 ' HB ' ' CZ2' ' A' ' 18' ' ' TRP . 3.9 m -65.43 102.51 0.7 Allowed 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.118 -1.225 . . . . 0.0 109.503 179.484 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 4.9 m -104.01 113.22 40.32 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 179.128 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.558 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 43.7 t -51.1 107.31 0.17 Allowed 'General case' 0 N--CA 1.492 1.669 0 O-C-N 121.358 -0.839 . . . . 0.0 109.536 -179.327 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 36.6 m -57.79 -17.77 17.79 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.099 -1.0 . . . . 0.0 110.918 -179.256 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.505 ' OD1' HG11 ' A' ' 27' ' ' VAL . 3.0 m120 -86.14 -30.88 22.17 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.102 -0.999 . . . . 0.0 111.016 -179.975 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . . . . . . . . . 15.5 p -142.72 23.02 1.95 Allowed 'General case' 0 N--CA 1.5 2.047 0 O-C-N 120.571 -1.33 . . . . 0.0 111.437 -179.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.445 ' N ' ' O ' ' A' ' 7' ' ' CYS . 13.0 mm100 42.29 35.35 0.6 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.5 -0.75 . . . . 0.0 112.386 178.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.552 HG22 ' CB ' ' A' ' 7' ' ' CYS . 5.2 t -90.56 135.47 33.68 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.643 -1.286 . . . . 0.0 109.671 179.06 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 52.4 p -93.72 -18.46 22.08 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.537 -0.727 . . . . 0.0 109.749 179.778 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.524 ' HB ' HG13 ' A' ' 51' ' ' ILE . 69.3 p -111.58 126.11 54.65 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.023 -1.048 . . . . 0.0 109.329 179.859 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.405 ' O ' HD11 ' A' ' 51' ' ' ILE . 11.9 p -138.44 151.79 47.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.206 -0.934 . . . . 0.0 110.496 179.84 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.723 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 73.3 p -77.1 -32.75 56.82 Favored 'General case' 0 C--N 1.302 -1.494 0 N-CA-C 108.909 -0.774 . . . . 0.0 108.909 179.348 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.682 HD11 ' O6 ' ' B' ' 107' ' ' ' DG' . 52.4 mt -146.46 110.14 4.88 Favored 'General case' 0 N--CA 1.494 1.768 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 179.0 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.432 ' CZ2' ' HB ' ' A' ' 5' ' ' THR . 13.2 m95 -72.29 120.25 17.63 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.088 -1.008 . . . . 0.0 110.373 -179.194 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.8 mmt180 -106.51 82.17 1.69 Allowed 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.491 -0.755 . . . . 0.0 109.45 179.546 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.466 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 6.7 tpp180 -60.95 118.45 6.73 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.418 -0.801 . . . . 0.0 109.377 179.764 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.481 ' HB3' ' O ' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -82.63 143.53 47.41 Favored Pre-proline 0 N--CA 1.5 2.062 0 O-C-N 121.326 -0.858 . . . . 0.0 109.785 -179.638 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -55.97 -41.8 73.39 Favored 'Trans proline' 0 C--N 1.321 -0.89 0 C-N-CA 122.649 2.233 . . . . 0.0 111.103 -179.43 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 21.6 mmt -56.39 -24.2 43.07 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.261 -0.899 . . . . 0.0 109.506 179.33 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.55 36.97 1.5 Allowed Glycine 0 N--CA 1.497 2.745 0 N-CA-C 109.914 -1.275 . . . . 0.0 109.914 179.669 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.481 ' O ' ' HB3' ' A' ' 21' ' ' SER . 15.2 m-20 -134.18 99.22 13.58 Favored Pre-proline 0 N--CA 1.495 1.775 0 O-C-N 121.192 -1.181 . . . . 0.0 110.388 -179.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.558 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.8 Cg_endo -63.54 118.67 5.59 Favored 'Trans proline' 0 C--N 1.314 -1.275 0 C-N-CA 122.039 1.826 . . . . 0.0 110.208 179.039 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.505 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.1 m -125.28 128.82 73.02 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 CA-C-O 121.868 0.842 . . . . 0.0 110.3 179.855 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 6.6 p -53.39 135.51 39.1 Favored 'General case' 0 N--CA 1.486 1.34 0 CA-C-O 121.296 0.57 . . . . 0.0 109.73 179.684 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.633 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 22.9 t-20 -38.33 -47.2 1.19 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.627 -0.67 . . . . 0.0 112.035 -178.654 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.57 -46.13 27.74 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.223 -0.923 . . . . 0.0 110.858 -179.656 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.413 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 22.6 m -65.48 -42.93 91.66 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.256 -0.903 . . . . 0.0 108.789 179.455 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.01 -50.37 66.13 Favored Glycine 0 N--CA 1.494 2.547 0 N-CA-C 110.459 -1.056 . . . . 0.0 110.459 179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.559 HD23 ' CE ' ' A' ' 36' ' ' LYS . 68.1 mt -59.04 -66.72 0.46 Allowed 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.369 -1.077 . . . . 0.0 109.608 -179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.524 ' CZ ' ' HG3' ' A' ' 42' ' ' ARG . 29.8 t80 -43.84 -38.46 3.32 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.558 -0.714 . . . . 0.0 109.687 179.619 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.548 ' O ' ' N ' ' A' ' 39' ' ' GLN . 15.9 t80 -62.02 -46.12 90.59 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.307 -0.87 . . . . 0.0 110.591 179.727 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.559 ' CE ' HD23 ' A' ' 33' ' ' LEU . 0.1 OUTLIER -60.37 -22.34 63.19 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.219 -1.551 . . . . 0.0 110.251 -179.893 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.583 ' N ' HD12 ' A' ' 37' ' ' LEU . 7.2 mp -82.11 -55.54 4.5 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.021 -1.049 . . . . 0.0 110.027 -179.291 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.471 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 34.5 m-70 -97.44 -27.33 14.5 Favored 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.249 -0.907 . . . . 0.0 110.49 -179.813 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.548 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 70.35 24.44 4.71 Favored 'General case' 0 N--CA 1.502 2.168 0 CA-C-O 121.591 0.71 . . . . 0.0 111.204 -179.885 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.6 m -124.83 164.6 23.26 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 O-C-N 121.015 -1.053 . . . . 0.0 109.984 178.75 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.5 p30 -83.55 151.6 25.3 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.513 -0.742 . . . . 0.0 109.773 179.541 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.524 ' HG3' ' CZ ' ' A' ' 34' ' ' TYR . 13.2 mmt180 -133.84 147.65 65.11 Favored Pre-proline 0 N--CA 1.494 1.74 0 O-C-N 121.387 -0.82 . . . . 0.0 110.002 179.672 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.479 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 1.0 OUTLIER -65.64 150.41 86.42 Favored 'Trans proline' 0 C--N 1.316 -1.145 0 C-N-CA 122.541 2.161 . . . . 0.0 110.656 179.671 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.472 ' O ' ' HB3' ' A' ' 47' ' ' ARG . 1.0 OUTLIER -68.6 0.92 3.57 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.192 -0.942 . . . . 0.0 110.876 179.462 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -52.0 -35.08 45.46 Favored 'General case' 0 N--CA 1.501 2.101 0 O-C-N 120.936 -1.102 . . . . 0.0 110.257 179.555 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -79.59 -29.14 41.1 Favored 'General case' 0 N--CA 1.503 2.188 0 O-C-N 121.11 -0.994 . . . . 0.0 109.724 179.3 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.472 ' HB3' ' O ' ' A' ' 44' ' ' LEU . 0.5 OUTLIER -50.16 142.6 9.48 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.325 -0.859 . . . . 0.0 110.09 179.75 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -98.48 172.27 7.63 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.469 -0.769 . . . . 0.0 109.859 179.828 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -66.53 -66.25 0.58 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.337 -0.852 . . . . 0.0 109.853 -179.817 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -117.0 164.4 12.41 Favored Glycine 0 N--CA 1.495 2.617 0 N-CA-C 109.012 -1.635 . . . . 0.0 109.012 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.524 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.0 mt -46.49 123.1 1.0 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.866 0 O-C-N 121.468 -1.019 . . . . 0.0 110.311 -179.724 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.511 ' HG3' ' N ' ' A' ' 53' ' ' THR . 0.0 OUTLIER -77.18 166.54 23.1 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.364 -0.835 . . . . 0.0 109.482 179.863 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.511 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.67 162.21 40.62 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.335 -0.853 . . . . 0.0 108.985 178.704 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 32.1 mmt180 -143.32 -162.06 1.38 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.54 -0.725 . . . . 0.0 109.661 -179.349 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.9 m120 -62.42 117.14 5.75 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.98 -1.075 . . . . 0.0 109.089 179.339 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.408 ' HD3' " O3'" ' C' ' 125' ' ' ' DT' . 0.0 OUTLIER -49.53 134.63 19.27 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.541 -0.725 . . . . 0.0 110.898 -178.862 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 19.1 ttpt -62.81 148.06 48.09 Favored 'General case' 0 N--CA 1.498 1.973 0 O-C-N 121.64 -0.662 . . . . 0.0 109.976 179.838 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 5.0 p -59.95 143.91 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.776 0 O-C-N 121.337 -0.852 . . . . 0.0 109.306 179.58 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -70.08 137.75 51.47 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.203 -0.936 . . . . 0.0 109.491 -179.816 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.813 0 O-C-N 121.466 -0.772 . . . . 0.0 109.347 -179.646 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.566 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.722 0 O4'-C1'-N19 110.361 3.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.566 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.757 1 O4'-C1'-N19 111.76 4.95 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.617 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.122 0 O4'-C1'-N19 110.916 3.895 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.617 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.179 0 O4'-C1'-N19 110.972 3.965 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.474 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.937 0 O4'-C1'-N19 110.664 3.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.893 0 O4'-C1'-N19 110.641 3.551 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.402 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.678 1 O4'-C1'-N19 111.268 4.335 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.402 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.78 0 O4'-C1'-N19 110.316 3.145 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.646 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.743 0 O4'-C1'-N19 110.908 3.885 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.646 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.538 1 O4'-C1'-N19 112.075 5.344 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.554 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.424 1 O4'-C1'-N19 111.177 4.221 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.554 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.845 0 O4'-C1'-N19 110.495 3.368 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.677 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.532 2.605 0 O4'-C1'-N19 110.289 3.111 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.907 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.787 1 O4'-C1'-N19 112.551 5.939 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.5 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.752 0 O4'-C1'-N19 110.949 3.936 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.45 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.53 2.42 0 O4'-C1'-N19 110.742 3.677 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 2.3 mtmp? . . . . . 0 N--CA 1.498 1.943 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.57 -30.57 71.67 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.193 -0.942 . . . . 0.0 109.172 179.496 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.51 111.17 3.98 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.375 -0.828 . . . . 0.0 109.045 179.054 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 124.3 -15.05 7.75 Favored Glycine 0 N--CA 1.497 2.729 0 N-CA-C 109.947 -1.261 . . . . 0.0 109.947 -179.336 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.65 HG23 ' HB2' ' A' ' 26' ' ' PRO . 5.9 m -66.56 92.6 0.21 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.217 -1.167 . . . . 0.0 109.155 179.475 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 22.3 m -84.66 131.0 35.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 121.066 -1.021 . . . . 0.0 108.27 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.539 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 17.3 t -59.02 116.42 3.8 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 121.288 -0.882 . . . . 0.0 110.765 -178.722 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 15.1 m -62.01 -12.46 18.87 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.368 -0.832 . . . . 0.0 110.83 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.697 ' OD1' HG11 ' A' ' 27' ' ' VAL . 7.8 m120 -106.8 -25.31 11.76 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 120.946 -1.096 . . . . 0.0 111.516 -179.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.616 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 10.8 p -142.69 18.39 2.0 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.65 -1.281 . . . . 0.0 111.255 179.655 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.8 mt-30 46.83 21.34 0.14 Allowed 'General case' 0 N--CA 1.507 2.423 0 O-C-N 121.405 -0.809 . . . . 0.0 112.555 178.469 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.564 HG22 ' SG ' ' A' ' 10' ' ' CYS . 7.5 t -87.14 121.83 30.13 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.513 -1.367 . . . . 0.0 109.849 179.565 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -89.29 -26.67 21.02 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.638 -0.875 . . . . 0.0 108.638 179.526 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.498 ' HB ' HG13 ' A' ' 51' ' ' ILE . 6.3 p -89.14 96.22 10.63 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.427 -0.796 . . . . 0.0 108.958 179.317 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.53 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 5.3 p -118.02 166.41 12.57 Favored 'General case' 0 N--CA 1.491 1.608 0 C-N-CA 119.57 -0.852 . . . . 0.0 110.014 -179.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.907 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 69.4 p -96.02 -38.06 10.37 Favored 'General case' 0 C--N 1.297 -1.7 0 N-CA-C 109.137 -0.69 . . . . 0.0 109.137 179.598 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.698 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 17.0 mt -137.4 90.56 2.52 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.305 -0.872 . . . . 0.0 108.662 178.839 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.53 ' CZ2' HG23 ' A' ' 15' ' ' THR . 10.8 m95 -54.12 113.59 1.3 Allowed 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.118 -0.989 . . . . 0.0 110.433 -179.365 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.483 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 3.0 tpp180 -99.75 86.18 3.26 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.276 -0.89 . . . . 0.0 109.014 179.795 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.408 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.4 mmm180 -71.2 90.93 0.92 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.281 -0.887 . . . . 0.0 109.019 179.893 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.3 t -55.24 142.65 57.98 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.456 -0.777 . . . . 0.0 110.254 -179.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -56.68 -30.89 85.68 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 C-N-CA 122.682 2.254 . . . . 0.0 110.976 -179.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.28 -22.99 62.02 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.314 -0.866 . . . . 0.0 109.534 179.013 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.35 40.74 1.6 Allowed Glycine 0 N--CA 1.496 2.685 0 N-CA-C 109.543 -1.423 . . . . 0.0 109.543 -179.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.6 m-20 -136.18 105.05 9.47 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.246 -1.15 . . . . 0.0 110.347 -179.549 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.65 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.3 Cg_endo -64.98 91.96 0.2 Allowed 'Trans proline' 0 C--N 1.314 -1.283 0 C-N-CA 122.337 2.025 . . . . 0.0 109.914 179.02 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.697 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.5 m -109.99 125.61 67.19 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.836 0 O-C-N 121.057 -1.027 . . . . 0.0 110.573 -179.669 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.502 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.6 p -49.21 133.5 19.06 Favored 'General case' 0 C--N 1.305 -1.364 0 O-C-N 121.591 -0.693 . . . . 0.0 110.189 179.759 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.698 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 4.7 t-20 -39.92 -40.16 0.96 Allowed 'General case' 0 N--CA 1.506 2.339 0 O-C-N 121.577 -0.702 . . . . 0.0 111.586 -179.131 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -52.54 -43.27 65.08 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.113 -0.992 . . . . 0.0 110.047 179.539 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 6.5 m -64.29 -41.52 96.83 Favored 'General case' 0 N--CA 1.497 1.903 0 N-CA-C 108.616 -0.883 . . . . 0.0 108.616 178.843 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.55 -36.55 93.36 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 109.255 -1.538 . . . . 0.0 109.255 178.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.476 ' HB3' ' H73' ' C' ' 123' ' ' ' DT' . 83.5 mt -73.3 -62.97 1.29 Allowed 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.545 -0.974 . . . . 0.0 110.168 179.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.675 ' HA ' HD22 ' A' ' 37' ' ' LEU . 89.2 t80 -51.81 -34.43 40.16 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.128 -0.983 . . . . 0.0 109.141 179.7 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.469 ' O ' ' N ' ' A' ' 39' ' ' GLN . 36.0 t80 -58.0 -52.68 64.52 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 121.428 -0.795 . . . . 0.0 109.22 178.69 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 tttp -55.08 -31.33 61.1 Favored 'General case' 0 N--CA 1.5 2.063 0 O-C-N 121.074 -1.016 . . . . 0.0 110.433 179.752 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.675 HD22 ' HA ' ' A' ' 34' ' ' TYR . 2.2 mp -61.29 -68.11 0.34 Allowed 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.215 -0.928 . . . . 0.0 110.576 -179.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.498 ' CB ' HG22 ' A' ' 40' ' ' VAL . 75.6 m-70 -96.9 10.0 40.32 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.053 -1.03 . . . . 0.0 110.412 -179.877 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.491 ' HG3' ' O ' ' A' ' 38' ' ' HIS . 1.9 pt20 45.14 31.32 0.74 Allowed 'General case' 0 N--CA 1.508 2.454 0 O-C-N 121.643 -0.661 . . . . 0.0 111.09 -179.158 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.6 m -127.96 -170.01 0.65 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 O-C-N 121.351 -0.843 . . . . 0.0 109.582 179.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 7.4 p30 -60.62 178.63 0.21 Allowed 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.274 -0.891 . . . . 0.0 110.558 179.695 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 0.1 OUTLIER -131.52 106.43 14.42 Favored Pre-proline 0 N--CA 1.497 1.909 0 O-C-N 121.073 -1.017 . . . . 0.0 109.915 -179.031 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.2 Cg_exo -60.08 133.98 53.45 Favored 'Trans proline' 0 C--N 1.317 -1.083 0 C-N-CA 122.387 2.058 . . . . 0.0 111.162 -179.934 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.619 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -91.01 -1.6 57.79 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.288 -0.882 . . . . 0.0 110.928 -179.83 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.408 HG23 ' H ' ' A' ' 45' ' ' THR . 3.1 p -58.07 -16.68 13.84 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 121.067 -1.02 . . . . 0.0 110.903 179.907 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 18.0 ttp -94.84 -5.16 45.69 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 120.885 -1.134 . . . . 0.0 111.036 179.896 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.462 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -81.08 168.99 18.01 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 120.549 -1.344 . . . . 0.0 110.335 -179.973 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 mmmt -132.85 -174.83 3.58 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.226 -0.921 . . . . 0.0 109.735 179.815 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 32.8 t70 -77.09 -17.91 58.37 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.492 -0.755 . . . . 0.0 110.481 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.48 148.76 19.62 Favored Glycine 0 N--CA 1.5 2.944 0 N-CA-C 109.698 -1.361 . . . . 0.0 109.698 179.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.508 HG21 HG22 ' A' ' 16' ' ' THR . 5.0 mt -53.33 110.44 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.875 0 O-C-N 121.311 -1.111 . . . . 0.0 110.091 179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -47.03 123.19 5.04 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.831 -0.543 . . . . 0.0 109.955 179.645 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.3 OUTLIER -148.58 156.44 42.43 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 121.005 -1.06 . . . . 0.0 110.51 179.581 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -153.38 -154.85 0.55 Allowed 'General case' 0 N--CA 1.492 1.63 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 179.52 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.6 p30 -62.98 87.05 0.03 OUTLIER 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.045 -1.035 . . . . 0.0 108.615 178.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.408 ' CB ' " H4'" ' C' ' 125' ' ' ' DT' . 4.9 ptt180 -50.81 156.55 0.94 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.397 -0.814 . . . . 0.0 110.715 -178.743 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.5 ttpm? -49.48 135.77 17.48 Favored 'General case' 0 N--CA 1.496 1.861 0 O-C-N 121.628 -0.67 . . . . 0.0 109.794 179.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 22.0 m -63.83 177.13 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 O-C-N 121.429 -0.795 . . . . 0.0 109.783 -179.931 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.4 p -78.08 126.16 30.41 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.122 -0.986 . . . . 0.0 109.978 179.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.2 t . . . . . 0 N--CA 1.497 1.896 0 O-C-N 121.504 -0.748 . . . . 0.0 109.812 179.902 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.54 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.908 0 C3'-C2'-C1' 106.982 3.059 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.54 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.441 1.622 1 O4'-C1'-N19 112.115 5.393 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.637 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.542 1 O4'-C1'-N19 111.344 4.43 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.637 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.653 1 O4'-C1'-N19 111.336 4.42 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.52 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.909 0 O4'-C1'-N19 110.563 3.454 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.892 0 O4'-C1'-N19 110.479 3.348 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.444 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.983 1 O4'-C1'-N19 111.002 4.003 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.444 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.068 0 C3'-C2'-C1' 107.078 3.127 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.633 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.87 0 O4'-C1'-N19 110.772 3.714 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.633 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.529 2.263 1 O4'-C1'-N19 111.682 4.853 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.433 ' C5 ' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.287 0 O4'-C1'-N19 110.875 3.843 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.5 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.093 0 O4'-C1'-N19 110.421 3.277 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.5 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.43 0 O4'-C1'-N19 110.446 3.308 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.589 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.982 1 O4'-C1'-N19 112.087 5.359 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.589 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.405 0 O4'-C1'-N19 110.391 3.238 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.498 ' C6 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.516 1 O4'-C1'-N19 111.055 4.069 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 12.8 pttt . . . . . 0 N--CA 1.499 1.988 0 CA-C-O 120.932 0.396 . . . . 0.0 110.454 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 -80.06 71.93 6.82 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.534 -1.354 . . . . 0.0 110.268 -179.792 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -61.38 143.09 56.38 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.398 -0.814 . . . . 0.0 109.343 179.402 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 107.6 -35.48 4.98 Favored Glycine 0 N--CA 1.498 2.791 0 N-CA-C 109.479 -1.448 . . . . 0.0 109.479 -179.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.473 HG23 ' CB ' ' A' ' 26' ' ' PRO . 58.8 m -72.13 93.17 1.4 Allowed 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.341 -1.093 . . . . 0.0 109.21 179.389 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 27.2 m -86.19 130.16 37.01 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.684 0 N-CA-C 108.343 -0.984 . . . . 0.0 108.343 179.628 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.506 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 42.6 t -61.31 115.3 3.73 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.118 -0.988 . . . . 0.0 110.564 -178.884 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 22.2 m -62.02 -12.73 20.27 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.416 -0.803 . . . . 0.0 110.864 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.449 ' ND2' HG11 ' A' ' 27' ' ' VAL . 57.2 m-20 -101.59 -30.14 11.55 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.068 -1.02 . . . . 0.0 110.989 -179.615 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 14.5 p -141.51 26.06 1.98 Allowed 'General case' 0 N--CA 1.499 2.015 0 O-C-N 120.625 -1.297 . . . . 0.0 111.336 -179.831 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.632 ' HB2' HD22 ' A' ' 44' ' ' LEU . 12.4 mt-30 41.82 20.93 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.613 0 O-C-N 121.307 -0.871 . . . . 0.0 113.163 178.726 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.48 HG22 ' SG ' ' A' ' 10' ' ' CYS . 7.3 t -85.64 132.96 34.06 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.411 -1.431 . . . . 0.0 109.945 -179.973 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 12.0 t -90.66 -30.41 17.16 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.534 -0.729 . . . . 0.0 109.313 179.72 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 16.5 p -89.98 131.38 35.9 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.332 -0.855 . . . . 0.0 108.861 179.005 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.493 ' C ' HD11 ' A' ' 51' ' ' ILE . 19.9 p -148.74 155.8 41.49 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.055 -1.028 . . . . 0.0 110.205 -179.606 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.527 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 27.2 p -75.05 -44.86 45.28 Favored 'General case' 0 N--CA 1.49 1.573 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.016 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.511 HD11 ' N6 ' ' B' ' 106' ' ' ' DA' . 9.2 mt -144.84 114.05 7.0 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.9 -0.778 . . . . 0.0 108.9 179.116 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.415 ' CZ2' ' O ' ' A' ' 5' ' ' THR . 15.7 m95 -65.97 103.38 0.93 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.308 -0.87 . . . . 0.0 110.273 -179.111 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.486 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 3.8 tpp180 -81.35 71.36 8.34 Favored 'General case' 0 N--CA 1.49 1.547 0 N-CA-C 108.265 -1.013 . . . . 0.0 108.265 178.97 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.492 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.43 105.07 0.47 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.287 -0.883 . . . . 0.0 109.464 -179.595 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.419 ' OG ' ' HD2' ' A' ' 22' ' ' PRO . 0.3 OUTLIER -66.88 147.76 99.0 Favored Pre-proline 0 N--CA 1.501 2.113 0 O-C-N 121.295 -0.878 . . . . 0.0 110.193 -179.394 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.419 ' HD2' ' OG ' ' A' ' 21' ' ' SER . 6.2 Cg_exo -54.95 -38.06 93.14 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.586 2.191 . . . . 0.0 111.105 -179.537 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -58.22 -23.59 56.32 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.314 -0.867 . . . . 0.0 109.584 179.237 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.74 36.98 1.63 Allowed Glycine 0 N--CA 1.497 2.749 0 N-CA-C 110.147 -1.181 . . . . 0.0 110.147 179.657 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -123.38 101.0 38.09 Favored Pre-proline 0 N--CA 1.495 1.782 0 O-C-N 121.018 -1.283 . . . . 0.0 110.426 -179.834 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.492 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 2.4 Cg_endo -65.05 91.4 0.2 Allowed 'Trans proline' 0 C--N 1.312 -1.364 0 C-N-CA 122.214 1.943 . . . . 0.0 110.096 178.707 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.506 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.6 m -109.24 127.48 65.92 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.249 -0.907 . . . . 0.0 110.04 179.946 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.44 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 9.2 p -51.55 134.1 29.68 Favored 'General case' 0 C--N 1.305 -1.329 0 O-C-N 121.666 -0.646 . . . . 0.0 109.622 179.708 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 17.0 t-20 -39.88 -44.91 1.73 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.546 -0.722 . . . . 0.0 111.545 -178.482 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.42 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -49.95 -44.17 50.46 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.475 -0.765 . . . . 0.0 110.48 -179.639 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . . . . . . . . . 2.6 m -61.59 -46.69 88.77 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.294 -0.879 . . . . 0.0 108.918 179.352 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -54.75 -38.59 64.63 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 110.338 -1.105 . . . . 0.0 110.338 179.701 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 80.2 mt -77.73 -60.56 2.32 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.422 -1.046 . . . . 0.0 109.739 179.997 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.643 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 32.9 t80 -49.52 -40.15 36.74 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.331 -0.856 . . . . 0.0 109.443 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.457 ' O ' ' N ' ' A' ' 39' ' ' GLN . 27.2 t80 -56.15 -49.37 74.15 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.511 -0.743 . . . . 0.0 109.44 179.289 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -58.74 -32.27 69.09 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 120.869 -1.144 . . . . 0.0 110.049 179.409 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.425 HD13 ' HA ' ' A' ' 34' ' ' TYR . 4.8 mp -60.37 -67.87 0.35 Allowed 'General case' 0 N--CA 1.503 2.198 0 O-C-N 121.194 -0.941 . . . . 0.0 110.593 -179.493 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.663 ' O ' HG22 ' A' ' 40' ' ' VAL . 56.3 m-70 -95.16 9.83 38.17 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.147 -0.97 . . . . 0.0 110.2 -179.772 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.491 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 8.2 pt20 46.65 29.07 0.88 Allowed 'General case' 0 N--CA 1.506 2.359 0 O-C-N 121.655 -0.653 . . . . 0.0 111.29 -178.991 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.663 HG22 ' O ' ' A' ' 38' ' ' HIS . 4.6 m -141.55 165.66 18.28 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.399 0 O-C-N 121.315 -0.866 . . . . 0.0 109.816 179.476 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -85.79 166.94 15.67 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.194 -0.941 . . . . 0.0 109.581 179.244 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.643 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 1.2 mmt180 -147.43 150.29 36.91 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 121.035 -1.041 . . . . 0.0 109.801 179.575 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.5 ' HD2' ' CD ' ' A' ' 42' ' ' ARG . 6.1 Cg_exo -56.54 150.25 52.97 Favored 'Trans proline' 0 C--N 1.315 -1.204 0 C-N-CA 122.341 2.027 . . . . 0.0 110.584 179.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.632 HD22 ' HB2' ' A' ' 11' ' ' GLN . 1.2 pp -74.64 1.36 12.38 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 121.372 -0.83 . . . . 0.0 111.459 -179.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.2 t -59.5 -14.76 14.01 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 120.817 -1.177 . . . . 0.0 110.766 179.388 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 9.3 ttt -72.81 -37.43 67.51 Favored 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.918 -1.114 . . . . 0.0 110.489 -179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.483 ' CZ ' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -81.75 169.77 16.53 Favored 'General case' 0 N--CA 1.503 2.199 0 O-C-N 121.095 -1.003 . . . . 0.0 110.229 -179.704 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -122.41 -169.9 1.98 Allowed 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.125 -0.984 . . . . 0.0 110.229 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -47.72 -82.33 0.01 OUTLIER 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.582 -0.699 . . . . 0.0 110.92 -179.554 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -87.37 165.89 35.99 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.957 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.493 HD11 ' C ' ' A' ' 15' ' ' THR . 5.9 mt -54.3 136.63 15.93 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.764 0 O-C-N 121.003 -1.292 . . . . 0.0 110.109 -179.813 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.7 mt-30 -66.36 138.09 57.35 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.677 -0.639 . . . . 0.0 109.825 179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.85 163.63 38.97 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.093 -1.004 . . . . 0.0 109.593 179.058 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.87 -157.42 0.81 Allowed 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.507 -0.745 . . . . 0.0 109.294 -179.653 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.1 t-20 -59.67 135.14 57.59 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 120.968 -1.082 . . . . 0.0 109.487 179.752 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.447 ' HD2' " O3'" ' C' ' 125' ' ' ' DT' . 10.0 tpp180 -55.22 140.56 38.48 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.596 -0.69 . . . . 0.0 110.216 -179.431 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -72.5 134.1 45.12 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 179.393 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.403 HG12 ' H ' ' A' ' 58' ' ' VAL . 0.4 OUTLIER -52.57 132.76 14.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.922 0 O-C-N 121.36 -0.837 . . . . 0.0 109.142 179.5 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 57.7 p -50.09 139.46 14.2 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.507 -0.746 . . . . 0.0 110.194 -179.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.496 1.826 0 O-C-N 121.671 -0.643 . . . . 0.0 110.149 -179.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.482 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.612 1.888 0 C3'-C2'-C1' 107.158 3.184 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.725 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.442 1.696 0 O4'-C1'-N19 110.788 3.735 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.77 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.146 1 O4'-C1'-N19 111.198 4.247 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.77 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.144 0 O4'-C1'-N19 110.855 3.819 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.504 H2'' ' C8 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.818 0 O4'-C1'-N19 110.581 3.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.504 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.95 0 O4'-C1'-N19 110.56 3.45 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.009 0 O4'-C1'-N19 110.966 3.958 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 1.981 0 O4'-C1'-N19 110.517 3.396 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.652 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.685 0 O4'-C1'-N19 110.887 3.858 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.652 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.476 1 O4'-C1'-N19 111.706 4.882 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.531 2.458 1 O4'-C1'-N19 111.099 4.123 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.47 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.088 0 C3'-C2'-C1' 107.096 3.14 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.557 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.695 0 O4'-C1'-N19 110.374 3.217 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.654 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.296 1 O4'-C1'-N19 112.745 6.181 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.654 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.412 0 O4'-C1'-N19 110.795 3.743 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.426 ' OP1' ' HB2' ' A' ' 59' ' ' SER . . . . . . . . 0 C5'--C4' 1.525 1.81 0 O4'-C1'-N19 110.596 3.495 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 7.9 tptt . . . . . 0 N--CA 1.499 1.996 0 CA-C-O 121.25 0.548 . . . . 0.0 110.212 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -81.64 -26.66 34.6 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.038 -1.039 . . . . 0.0 109.528 179.366 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -59.79 150.16 29.0 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.167 -0.958 . . . . 0.0 108.839 179.072 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.511 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 95.74 -30.14 8.83 Favored Glycine 0 N--CA 1.495 2.629 0 N-CA-C 109.348 -1.501 . . . . 0.0 109.348 -178.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.514 HG23 ' CB ' ' A' ' 26' ' ' PRO . 11.2 m -58.31 93.46 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.231 -1.158 . . . . 0.0 109.063 179.25 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.511 HG13 ' O ' ' A' ' 4' ' ' GLY . 13.7 m -85.28 140.16 16.38 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.637 0 O-C-N 121.133 -0.979 . . . . 0.0 108.794 -179.735 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.705 ' HB2' HG22 ' A' ' 12' ' ' THR . 31.4 t -64.67 120.36 12.27 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.161 -0.962 . . . . 0.0 110.252 -179.379 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 m -63.23 -14.03 44.63 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.392 -0.817 . . . . 0.0 110.427 179.245 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 69.9 m-20 -107.64 -17.18 14.16 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.996 -1.065 . . . . 0.0 111.146 -179.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.51 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 8.4 p -154.01 24.31 0.5 Allowed 'General case' 0 N--CA 1.503 2.21 0 O-C-N 120.565 -1.335 . . . . 0.0 111.116 179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.445 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 7.7 pt20 33.73 34.41 0.01 OUTLIER 'General case' 0 N--CA 1.511 2.605 0 N-CA-C 113.555 0.946 . . . . 0.0 113.555 178.718 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.705 HG22 ' HB2' ' A' ' 7' ' ' CYS . 6.1 t -83.79 131.33 34.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 120.541 -1.349 . . . . 0.0 109.165 178.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.3 p -89.28 -1.1 57.94 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.315 -0.865 . . . . 0.0 109.18 179.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.5 p -128.35 132.25 48.59 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.489 -0.757 . . . . 0.0 109.241 179.198 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.528 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 5.7 p -144.9 158.77 43.69 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.306 -0.871 . . . . 0.0 109.543 179.588 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.636 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 48.8 p -85.95 -26.99 25.21 Favored 'General case' 0 N--CA 1.49 1.541 0 N-CA-C 108.75 -0.833 . . . . 0.0 108.75 178.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.725 HD11 ' O6 ' ' B' ' 107' ' ' ' DG' . 59.9 mt -146.48 94.62 2.47 Favored 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 178.938 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.528 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.7 m95 -57.8 115.6 2.92 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.969 -1.082 . . . . 0.0 110.395 -179.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -105.27 92.61 4.28 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.314 -0.866 . . . . 0.0 109.289 179.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.482 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -80.47 104.87 11.3 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.218 -0.926 . . . . 0.0 109.239 179.945 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 5.4 m -64.05 148.11 95.7 Favored Pre-proline 0 N--CA 1.5 2.053 0 O-C-N 121.145 -0.972 . . . . 0.0 110.123 -179.489 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -55.37 -44.92 44.13 Favored 'Trans proline' 0 C--N 1.319 -1.016 0 C-N-CA 122.771 2.314 . . . . 0.0 111.191 -179.62 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 41.2 mtt -57.76 -21.54 41.96 Favored 'General case' 0 N--CA 1.5 2.068 0 O-C-N 121.236 -0.915 . . . . 0.0 110.153 179.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.444 ' HA2' ' NH1' ' A' ' 20' ' ' ARG . . . 111.04 45.36 0.88 Allowed Glycine 0 N--CA 1.497 2.716 0 N-CA-C 109.591 -1.404 . . . . 0.0 109.591 179.929 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 12.5 m-20 -128.34 92.68 40.54 Favored Pre-proline 0 N--CA 1.491 1.623 0 O-C-N 121.572 -0.958 . . . . 0.0 110.172 -179.447 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.514 ' CB ' HG23 ' A' ' 5' ' ' THR . 2.7 Cg_endo -63.47 95.63 0.18 Allowed 'Trans proline' 0 C--N 1.312 -1.36 0 C-N-CA 122.08 1.854 . . . . 0.0 109.728 178.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.524 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.04 124.22 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.099 -1.0 . . . . 0.0 110.617 -179.67 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.493 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.3 p -49.17 136.15 15.56 Favored 'General case' 0 C--N 1.306 -1.286 0 O-C-N 121.653 -0.654 . . . . 0.0 109.867 179.258 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.663 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 12.2 t-20 -40.2 -41.08 1.23 Allowed 'General case' 0 N--CA 1.505 2.279 0 O-C-N 121.661 -0.65 . . . . 0.0 111.465 -179.235 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.44 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -50.83 -45.81 59.74 Favored 'General case' 0 N--CA 1.499 2.005 0 O-C-N 121.372 -0.83 . . . . 0.0 110.265 179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.454 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 34.6 m -67.92 -39.83 83.47 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.288 -0.882 . . . . 0.0 108.751 179.19 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.95 -39.21 95.28 Favored Glycine 0 N--CA 1.493 2.487 0 N-CA-C 109.607 -1.397 . . . . 0.0 109.607 179.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 65.0 mt -74.72 -60.74 2.14 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.415 -1.05 . . . . 0.0 109.881 179.992 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.568 ' CE1' ' HB3' ' A' ' 42' ' ' ARG . 47.3 t80 -49.22 -37.84 24.4 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.378 -0.826 . . . . 0.0 109.106 179.667 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.522 ' O ' ' N ' ' A' ' 39' ' ' GLN . 15.9 t80 -62.08 -52.88 62.13 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.543 -0.723 . . . . 0.0 109.659 179.314 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -51.42 -29.13 14.84 Favored 'General case' 0 N--CA 1.505 2.277 0 O-C-N 120.651 -1.28 . . . . 0.0 110.434 179.716 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 4.4 mp -68.32 -63.39 1.07 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.027 -1.046 . . . . 0.0 110.862 -179.57 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.454 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 9.7 m-70 -97.42 -32.44 11.85 Favored 'General case' 0 N--CA 1.506 2.328 0 O-C-N 121.126 -0.984 . . . . 0.0 110.214 -179.362 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.522 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.1 OUTLIER 81.87 26.73 0.18 Allowed 'General case' 0 N--CA 1.504 2.265 0 CA-C-O 121.699 0.761 . . . . 0.0 110.689 -179.853 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.6 m -130.63 168.18 24.1 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.325 0 O-C-N 120.857 -1.152 . . . . 0.0 109.754 178.947 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 11.8 p-10 -73.32 146.82 44.99 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.21 -0.931 . . . . 0.0 109.18 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.568 ' HB3' ' CE1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -128.5 149.94 73.12 Favored Pre-proline 0 N--CA 1.494 1.734 0 O-C-N 121.069 -1.02 . . . . 0.0 110.456 -179.346 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.423 ' O ' ' HD3' ' A' ' 42' ' ' ARG . 2.1 Cg_endo -62.33 135.67 55.28 Favored 'Trans proline' 0 C--N 1.316 -1.133 0 C-N-CA 122.506 2.137 . . . . 0.0 111.091 -179.892 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.51 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -84.54 29.54 0.59 Allowed 'General case' 0 N--CA 1.5 2.057 0 O-C-N 121.367 -0.833 . . . . 0.0 111.063 -179.944 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 9.0 t -61.21 -17.4 53.03 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.751 -1.218 . . . . 0.0 110.473 179.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -87.51 -7.53 57.48 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.899 -1.126 . . . . 0.0 110.608 179.284 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.447 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -73.34 113.52 10.51 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 120.61 -1.307 . . . . 0.0 109.251 179.967 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -106.84 -156.25 0.57 Allowed 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.474 -0.767 . . . . 0.0 110.172 -179.189 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER -66.03 -73.91 0.12 Allowed 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.472 -0.768 . . . . 0.0 110.328 -179.499 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -102.84 174.04 23.11 Favored Glycine 0 N--CA 1.497 2.715 0 N-CA-C 109.765 -1.334 . . . . 0.0 109.765 -179.972 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.606 HG21 HG22 ' A' ' 16' ' ' THR . 6.1 mt -59.02 135.26 23.72 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 O-C-N 121.279 -1.13 . . . . 0.0 110.005 179.922 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 5.2 mt-30 -69.84 161.6 29.57 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.448 -0.782 . . . . 0.0 110.133 179.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -156.51 168.75 26.42 Favored 'General case' 0 N--CA 1.499 2.006 0 O-C-N 121.38 -0.825 . . . . 0.0 109.048 179.71 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -149.89 -169.37 3.36 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.259 -0.9 . . . . 0.0 109.203 -179.858 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -56.17 100.13 0.04 OUTLIER 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.947 -1.096 . . . . 0.0 108.704 179.144 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 8.7 ttm180 -46.43 127.15 8.88 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.572 -0.705 . . . . 0.0 110.7 -178.419 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.7 ttpt -63.13 125.16 23.14 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.72 -0.612 . . . . 0.0 110.061 -179.97 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.432 HG12 ' N ' ' A' ' 59' ' ' SER . 47.2 t -74.87 158.34 5.82 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.84 0 O-C-N 121.475 -0.766 . . . . 0.0 109.678 179.931 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.432 ' N ' HG12 ' A' ' 58' ' ' VAL . 48.2 t -72.75 76.58 1.12 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.155 -0.966 . . . . 0.0 109.886 179.973 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 22.6 t . . . . . 0 N--CA 1.493 1.724 0 O-C-N 121.359 -0.838 . . . . 0.0 109.189 179.86 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.596 ' N7 ' HD22 ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.443 1.752 0 C3'-C2'-C1' 107.027 3.09 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.548 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.871 1 O4'-C1'-N19 111.988 5.235 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.634 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.471 1 O4'-C1'-N19 111.31 4.387 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.634 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.06 1 O4'-C1'-N19 111.122 4.153 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.537 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.704 0 O4'-C1'-N19 110.81 3.762 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.758 0 O4'-C1'-N19 110.504 3.38 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.865 0 O4'-C1'-N19 110.915 3.894 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 2.049 0 O4'-C1'-N19 110.427 3.284 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.777 ' C8 ' ' H71' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.903 1 O4'-C1'-N19 111.263 4.329 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.777 ' H71' ' C8 ' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.424 1 O4'-C1'-N19 112.287 5.608 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.417 ' C4 ' ' N3 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.527 1 O4'-C1'-N19 112.1 5.375 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.48 ' H73' ' HB3' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.526 1.877 0 O4'-C1'-N19 110.664 3.58 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.56 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.528 2.156 0 O4'-C1'-N19 110.606 3.508 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.61 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.314 1 O4'-C1'-N19 112.144 5.43 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.471 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.702 0 O4'-C1'-N19 110.946 3.933 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.455 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.486 1 O4'-C1'-N19 111.041 4.051 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.832 0 N-CA-C 109.59 -0.522 . . . . 0.0 109.59 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.2 mmt180 -100.5 43.05 1.08 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.333 -0.855 . . . . 0.0 109.452 -179.937 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.28 135.88 57.23 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.29 -0.881 . . . . 0.0 109.974 -179.784 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.98 0.86 65.69 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 110.322 -1.111 . . . . 0.0 110.322 -179.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.628 HG22 ' CH2' ' A' ' 18' ' ' TRP . 53.5 m -81.46 84.92 6.57 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.862 -1.375 . . . . 0.0 109.976 -179.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.57 HG23 ' O ' ' A' ' 6' ' ' VAL . 21.9 m -85.23 114.69 25.72 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.575 0 N-CA-C 107.449 -1.315 . . . . 0.0 107.449 178.658 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.652 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 1.7 t -42.61 113.22 0.44 Allowed 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.45 -0.781 . . . . 0.0 110.932 -178.135 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . 0.537 ' OG ' ' HD2' ' A' ' 26' ' ' PRO . 53.5 m -65.51 -12.58 54.09 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.134 -0.979 . . . . 0.0 111.276 -179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.826 ' HB2' HG12 ' A' ' 27' ' ' VAL . 0.7 OUTLIER -103.38 -24.84 13.46 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 120.955 -1.09 . . . . 0.0 110.583 179.833 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.518 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 9.2 p -144.7 25.83 1.44 Allowed 'General case' 0 N--CA 1.499 1.997 0 O-C-N 120.88 -1.137 . . . . 0.0 110.767 179.441 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.812 ' HB2' HD22 ' A' ' 44' ' ' LEU . 0.0 OUTLIER 38.96 25.6 0.01 OUTLIER 'General case' 0 N--CA 1.508 2.43 0 O-C-N 121.367 -0.833 . . . . 0.0 113.028 178.781 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.567 HG22 ' HB2' ' A' ' 7' ' ' CYS . 5.4 t -89.08 131.2 35.34 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 120.412 -1.43 . . . . 0.0 109.218 179.258 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 35.2 p -90.03 -29.82 18.15 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 179.827 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.493 ' HB ' ' CG1' ' A' ' 51' ' ' ILE . 2.9 p -93.79 124.8 38.03 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.419 -0.801 . . . . 0.0 109.438 179.687 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.601 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 11.9 p -134.01 140.15 46.51 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.35 -0.844 . . . . 0.0 109.244 179.835 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.61 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 70.4 p -62.14 -36.86 83.07 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 107.848 -1.168 . . . . 0.0 107.848 179.076 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.596 HD22 ' N7 ' ' B' ' 106' ' ' ' DA' . 13.2 mt -149.56 112.28 4.79 Favored 'General case' 0 N--CA 1.49 1.535 0 N-CA-C 108.179 -1.045 . . . . 0.0 108.179 178.587 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.628 ' CH2' HG22 ' A' ' 5' ' ' THR . 13.8 m95 -59.58 123.44 16.9 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.495 -0.753 . . . . 0.0 110.112 -179.008 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.576 ' O ' HG23 ' A' ' 27' ' ' VAL . 2.0 ttm180 -116.34 74.47 0.9 Allowed 'General case' 0 N--CA 1.49 1.566 0 N-CA-C 108.808 -0.812 . . . . 0.0 108.808 179.918 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -65.73 119.5 11.31 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.939 -1.101 . . . . 0.0 109.503 -179.96 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.436 ' OG ' HG22 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -86.91 142.62 34.28 Favored Pre-proline 0 N--CA 1.501 2.085 0 O-C-N 121.016 -1.053 . . . . 0.0 110.006 -179.67 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.5 Cg_exo -56.27 -28.67 72.7 Favored 'Trans proline' 0 C--N 1.32 -0.946 0 C-N-CA 122.722 2.281 . . . . 0.0 110.981 -179.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 2.5 mtp -55.45 -25.11 34.62 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.469 -0.77 . . . . 0.0 109.63 179.298 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.14 35.31 2.55 Favored Glycine 0 N--CA 1.496 2.639 0 N-CA-C 109.657 -1.377 . . . . 0.0 109.657 -179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.3 m-20 -137.8 108.38 8.4 Favored Pre-proline 0 N--CA 1.497 1.887 0 O-C-N 121.381 -1.07 . . . . 0.0 109.966 -179.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.537 ' HD2' ' OG ' ' A' ' 8' ' ' SER . 2.9 Cg_endo -60.7 99.7 0.15 Allowed 'Trans proline' 0 C--N 1.313 -1.309 0 C-N-CA 121.786 1.657 . . . . 0.0 110.087 179.299 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.826 HG12 ' HB2' ' A' ' 9' ' ' ASN . 2.1 m -109.97 147.51 14.23 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.173 -0.954 . . . . 0.0 109.745 179.721 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.448 ' N ' ' SG ' ' A' ' 7' ' ' CYS . 30.4 p -83.5 153.65 24.3 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.286 -0.884 . . . . 0.0 108.656 179.945 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.513 ' OD1' HD12 ' A' ' 33' ' ' LEU . 11.2 t-20 -41.36 -42.56 2.27 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.562 -0.712 . . . . 0.0 110.079 179.926 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -60.67 -43.46 97.62 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.32 -0.863 . . . . 0.0 110.794 179.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.521 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 1.7 m -58.97 -44.21 91.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.099 -1.001 . . . . 0.0 108.924 179.755 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -68.82 -38.78 85.69 Favored Glycine 0 N--CA 1.493 2.452 0 N-CA-C 109.839 -1.304 . . . . 0.0 109.839 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.518 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 36.3 mt -69.5 -66.07 0.63 Allowed 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.373 -1.075 . . . . 0.0 110.609 -179.584 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.593 ' HA ' HD13 ' A' ' 37' ' ' LEU . 80.2 t80 -49.91 -35.29 23.24 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.98 -1.075 . . . . 0.0 109.57 -179.812 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.572 ' CE1' ' HG3' ' A' ' 39' ' ' GLN . 29.4 t80 -61.76 -47.7 84.0 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.338 -0.851 . . . . 0.0 109.838 179.383 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.518 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -57.51 -24.36 55.52 Favored 'General case' 0 N--CA 1.505 2.312 0 O-C-N 120.038 -1.664 . . . . 0.0 110.633 179.528 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.593 HD13 ' HA ' ' A' ' 34' ' ' TYR . 2.3 mp -70.78 -67.55 0.5 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.999 -1.063 . . . . 0.0 110.189 179.858 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.445 ' HB2' HG22 ' A' ' 40' ' ' VAL . 12.8 m-70 -97.29 -22.12 16.85 Favored 'General case' 0 N--CA 1.505 2.298 0 O-C-N 121.198 -0.939 . . . . 0.0 110.147 -179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.572 ' HG3' ' CE1' ' A' ' 35' ' ' TYR . 1.1 tt0 65.27 48.75 2.08 Favored 'General case' 0 N--CA 1.501 2.124 0 CA-C-O 121.913 0.863 . . . . 0.0 110.438 179.663 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.4 m -142.21 169.54 13.2 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.255 0 O-C-N 121.294 -0.879 . . . . 0.0 109.012 179.225 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 34.4 p-10 -83.92 150.57 25.6 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.992 -1.067 . . . . 0.0 108.852 179.299 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.498 ' HG3' ' HD2' ' A' ' 43' ' ' PRO . 64.4 ttt180 -145.08 137.99 13.83 Favored Pre-proline 0 N--CA 1.497 1.908 0 O-C-N 120.818 -1.176 . . . . 0.0 110.236 -179.407 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.498 ' HD2' ' HG3' ' A' ' 42' ' ' ARG . 3.3 Cg_exo -59.94 151.18 73.58 Favored 'Trans proline' 0 C--N 1.317 -1.126 0 C-N-CA 122.462 2.108 . . . . 0.0 110.415 179.302 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.812 HD22 ' HB2' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -83.14 40.52 0.71 Allowed 'General case' 0 N--CA 1.497 1.911 0 O-C-N 121.06 -1.025 . . . . 0.0 111.144 -179.395 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 19.4 p -70.78 -10.13 58.86 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 120.913 -1.117 . . . . 0.0 110.309 179.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.0 ttm -102.3 -19.42 15.02 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.035 -1.041 . . . . 0.0 110.765 -179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 1.9 mpt_? -81.64 175.24 10.64 Favored 'General case' 0 N--CA 1.501 2.124 0 O-C-N 120.856 -1.153 . . . . 0.0 110.171 -179.886 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -160.7 166.09 29.39 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.31 -0.868 . . . . 0.0 109.696 179.626 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 84.4 m-20 -58.07 -28.25 64.37 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.309 -0.869 . . . . 0.0 110.342 179.917 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -109.17 123.39 6.88 Favored Glycine 0 N--CA 1.497 2.722 0 N-CA-C 109.283 -1.527 . . . . 0.0 109.283 179.453 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.517 HG21 HG22 ' A' ' 16' ' ' THR . 5.5 mt -53.37 136.6 14.57 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.94 0 O-C-N 121.418 -1.048 . . . . 0.0 110.075 -179.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -75.81 146.27 40.06 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.505 -0.747 . . . . 0.0 110.001 179.771 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.25 158.82 39.44 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.117 -0.989 . . . . 0.0 109.433 179.034 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -151.31 -162.39 1.53 Allowed 'General case' 0 N--CA 1.493 1.682 0 N-CA-C 109.058 -0.719 . . . . 0.0 109.058 179.966 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 11.7 t30 -54.13 103.63 0.09 Allowed 'General case' 0 N--CA 1.501 2.091 0 O-C-N 120.841 -1.162 . . . . 0.0 108.921 179.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.7 ptp180 -55.73 160.99 2.32 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 121.55 -0.719 . . . . 0.0 110.672 -178.878 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 1.4 ttmm -66.04 128.14 34.89 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.473 -0.767 . . . . 0.0 110.045 179.758 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 1.7 m -70.96 172.2 0.98 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 121.477 -0.764 . . . . 0.0 109.325 179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 28.2 p -82.65 119.38 24.22 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 120.948 -1.095 . . . . 0.0 108.808 179.217 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 38.6 t . . . . . 0 N--CA 1.497 1.9 0 O-C-N 121.107 -0.996 . . . . 0.0 109.743 -179.257 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.598 ' N7 ' HD22 ' A' ' 17' ' ' LEU . . . . . . . . 0 P--O5' 1.612 1.874 0 C3'-C2'-C1' 106.918 3.013 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.547 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.439 1.454 1 O4'-C1'-N19 111.878 5.097 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.632 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.213 0 O4'-C1'-N19 110.977 3.971 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.632 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.932 1 O4'-C1'-N19 111.302 4.377 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.585 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.67 0 O4'-C1'-N19 110.723 3.654 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.479 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.703 0 O4'-C1'-N19 110.925 3.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.479 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.726 1 O4'-C1'-N19 111.148 4.186 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.444 1.832 0 O4'-C1'-N19 110.552 3.441 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.683 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.523 1.543 1 O4'-C1'-N19 111.894 5.118 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.683 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.533 2.743 1 O4'-C1'-N19 111.639 4.799 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.47 ' N3 ' ' N1 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.099 1 O4'-C1'-N19 111.521 4.651 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.5 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.53 2.343 0 O4'-C1'-N19 110.627 3.534 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.623 " H2'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.532 2.587 0 O4'-C1'-N19 110.591 3.489 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.538 H2'' ' C6 ' ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.502 1 O4'-C1'-N19 112.271 5.588 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.538 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.806 0 O4'-C1'-N19 110.58 3.476 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.504 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.195 0 O4'-C1'-N19 110.841 3.801 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 25.6 mtmt . . . . . 0 N--CA 1.496 1.831 0 N-CA-C 109.425 -0.583 . . . . 0.0 109.425 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 12.8 tpt180 -77.19 -1.51 29.8 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.265 -0.897 . . . . 0.0 110.121 179.344 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -53.05 153.83 3.3 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.036 -1.04 . . . . 0.0 109.447 179.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.468 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 106.21 -28.61 13.12 Favored Glycine 0 N--CA 1.492 2.408 0 N-CA-C 108.944 -1.662 . . . . 0.0 108.944 -178.768 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.496 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 27.8 m -60.13 92.16 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.409 -1.054 . . . . 0.0 109.524 179.302 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.469 HG23 ' O ' ' A' ' 6' ' ' VAL . 35.3 m -93.33 119.0 40.38 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.532 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 179.741 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.956 ' HB2' HG22 ' A' ' 12' ' ' THR . 9.3 t -46.8 114.93 0.92 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.454 -0.778 . . . . 0.0 110.809 -178.482 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 58.4 m -63.13 -14.62 50.76 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.231 -0.918 . . . . 0.0 110.03 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 12.2 m-20 -98.7 -29.16 13.18 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.103 -0.998 . . . . 0.0 110.918 -179.586 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.601 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 10.4 p -143.16 25.79 1.71 Allowed 'General case' 0 N--CA 1.502 2.13 0 O-C-N 120.649 -1.282 . . . . 0.0 111.456 -179.719 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.415 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.1 OUTLIER 37.15 35.54 0.05 OUTLIER 'General case' 0 N--CA 1.51 2.552 0 O-C-N 121.592 -0.693 . . . . 0.0 112.76 178.866 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.956 HG22 ' HB2' ' A' ' 7' ' ' CYS . 9.5 t -88.27 138.27 31.59 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 120.704 -1.248 . . . . 0.0 109.464 179.481 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 77.3 p -101.13 -19.79 15.61 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.344 -0.848 . . . . 0.0 109.627 179.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.447 ' HB ' HG13 ' A' ' 51' ' ' ILE . 12.0 p -108.97 113.08 25.65 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.512 -0.743 . . . . 0.0 109.537 -179.561 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.626 ' C ' HD11 ' A' ' 51' ' ' ILE . 4.8 p -132.83 147.41 52.3 Favored 'General case' 0 N--CA 1.494 1.725 0 O-C-N 121.212 -0.93 . . . . 0.0 110.143 -179.875 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.627 HG22 HG21 ' A' ' 51' ' ' ILE . 29.9 p -73.57 -28.06 61.65 Favored 'General case' 0 N--CA 1.495 1.787 0 N-CA-C 108.353 -0.981 . . . . 0.0 108.353 179.042 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.598 HD22 ' N7 ' ' B' ' 106' ' ' ' DA' . 18.8 mt -149.81 120.24 7.4 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.515 -0.741 . . . . 0.0 109.196 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.468 ' CH2' HG21 ' A' ' 15' ' ' THR . 8.5 m95 -84.68 117.97 24.11 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.427 -0.796 . . . . 0.0 109.796 -179.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.568 ' HD2' ' HA ' ' A' ' 29' ' ' ASN . 0.0 OUTLIER -108.7 103.36 12.44 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.156 -0.965 . . . . 0.0 109.14 179.585 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.466 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 2.0 mmt180 -77.33 119.61 21.21 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.326 -0.859 . . . . 0.0 109.729 -179.495 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 55.7 m -75.33 149.75 84.57 Favored Pre-proline 0 N--CA 1.497 1.917 0 O-C-N 121.334 -0.854 . . . . 0.0 110.113 -179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.6 Cg_exo -53.66 -47.76 25.51 Favored 'Trans proline' 0 C--N 1.321 -0.9 0 C-N-CA 122.793 2.328 . . . . 0.0 111.147 -179.758 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 7.6 ttt -55.71 -25.55 40.68 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.291 -0.881 . . . . 0.0 109.435 179.232 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 114.49 45.62 0.66 Allowed Glycine 0 N--CA 1.492 2.395 0 N-CA-C 109.688 -1.365 . . . . 0.0 109.688 179.72 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 4.7 m-20 -132.11 102.98 14.24 Favored Pre-proline 0 N--CA 1.495 1.811 0 O-C-N 121.288 -1.125 . . . . 0.0 111.026 -179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.496 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 2.5 Cg_endo -65.42 105.14 0.7 Allowed 'Trans proline' 0 C--N 1.315 -1.231 0 C-N-CA 122.323 2.015 . . . . 0.0 109.7 178.279 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.539 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -116.45 126.69 74.03 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.927 0 O-C-N 121.317 -0.864 . . . . 0.0 110.736 -179.795 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.45 ' HB3' ' CG2' ' A' ' 12' ' ' THR . 8.1 p -49.92 139.91 12.89 Favored 'General case' 0 N--CA 1.487 1.41 0 O-C-N 121.648 -0.658 . . . . 0.0 109.787 179.167 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.568 ' HA ' ' HD2' ' A' ' 19' ' ' ARG . 18.2 t-20 -43.13 -46.71 5.95 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.357 -0.839 . . . . 0.0 112.218 -178.39 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -46.43 -45.97 18.44 Favored 'General case' 0 N--CA 1.502 2.166 0 O-C-N 121.346 -0.846 . . . . 0.0 110.615 -179.659 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 9.9 m -63.23 -44.92 93.9 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.682 -0.636 . . . . 0.0 109.37 179.623 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.47 -49.36 77.94 Favored Glycine 0 N--CA 1.496 2.644 0 N-CA-C 110.867 -0.893 . . . . 0.0 110.867 -179.667 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.419 HD13 ' H62' ' C' ' 124' ' ' ' DA' . 42.2 mt -67.04 -60.6 2.49 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.473 -1.016 . . . . 0.0 109.938 -179.614 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.487 ' HB2' ' OP2' ' C' ' 123' ' ' ' DT' . 50.6 t80 -51.41 -43.24 61.93 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.567 -0.708 . . . . 0.0 109.619 179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.531 ' HB2' ' O ' ' A' ' 31' ' ' CYS . 47.6 t80 -53.38 -47.33 69.58 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.411 -0.806 . . . . 0.0 108.866 179.265 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.02 -43.09 99.58 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.057 -1.027 . . . . 0.0 110.358 179.354 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.417 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 9.6 mp -40.86 -56.62 2.17 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 121.506 -0.747 . . . . 0.0 110.705 -179.175 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.479 ' HB2' HG22 ' A' ' 40' ' ' VAL . 41.2 m-70 -115.1 6.46 15.17 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.171 -0.956 . . . . 0.0 110.288 179.711 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.496 ' N ' ' O ' ' A' ' 35' ' ' TYR . 1.7 tm0? 49.36 34.71 6.77 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.397 -0.815 . . . . 0.0 110.13 -179.262 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.479 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.7 m -141.05 167.14 17.59 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.195 0 O-C-N 121.121 -0.987 . . . . 0.0 110.17 -179.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.5 p-10 -84.53 156.35 21.71 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.505 -0.747 . . . . 0.0 109.747 179.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.508 ' CG ' ' HD2' ' A' ' 43' ' ' PRO . 0.0 OUTLIER -151.08 152.07 30.7 Favored Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.296 -0.878 . . . . 0.0 109.545 179.723 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.508 ' HD2' ' CG ' ' A' ' 42' ' ' ARG . 4.6 Cg_exo -55.41 143.78 75.63 Favored 'Trans proline' 0 C--N 1.316 -1.174 0 C-N-CA 122.313 2.009 . . . . 0.0 111.147 -179.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.601 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -95.46 37.71 1.18 Allowed 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.464 -0.773 . . . . 0.0 110.561 -179.582 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -70.57 -6.64 37.97 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.946 -1.096 . . . . 0.0 110.038 178.811 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 38.1 mtp -92.15 -16.0 26.89 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.979 -1.075 . . . . 0.0 110.303 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.58 ' HG2' ' HB2' ' A' ' 44' ' ' LEU . 25.3 mmm180 -56.43 151.28 13.49 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 120.728 -1.232 . . . . 0.0 109.591 -179.999 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 6.3 tttp -139.53 155.35 47.57 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.447 -0.783 . . . . 0.0 109.871 179.751 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.1 OUTLIER -49.67 -77.59 0.02 OUTLIER 'General case' 0 N--CA 1.503 2.217 0 O-C-N 121.616 -0.678 . . . . 0.0 110.49 -179.775 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -83.4 148.4 25.16 Favored Glycine 0 N--CA 1.494 2.542 0 N-CA-C 109.319 -1.512 . . . . 0.0 109.319 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.627 HG21 HG22 ' A' ' 16' ' ' THR . 10.1 mt -54.25 136.89 15.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.324 -1.104 . . . . 0.0 109.773 -179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.505 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -75.48 156.0 35.65 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.552 -0.718 . . . . 0.0 109.836 -179.96 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.446 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.99 163.01 40.24 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.439 -0.788 . . . . 0.0 109.045 178.835 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.423 ' HD3' ' HA ' ' A' ' 54' ' ' ARG . 15.6 mmt180 -147.67 -165.81 2.36 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 109.157 -0.683 . . . . 0.0 109.157 -179.846 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 7.4 p-10 -57.35 111.0 0.95 Allowed 'General case' 0 N--CA 1.495 1.807 0 O-C-N 120.823 -1.173 . . . . 0.0 108.863 179.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 3.1 ttm180 -46.21 128.3 9.48 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.332 -0.855 . . . . 0.0 111.111 -178.284 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 5.8 ttmt -63.01 117.58 6.64 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.637 -0.664 . . . . 0.0 109.322 179.469 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.4 m -71.14 178.4 0.44 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.741 0 O-C-N 121.447 -0.783 . . . . 0.0 109.868 -179.481 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 2.0 t -83.48 139.56 32.85 Favored 'General case' 0 N--CA 1.498 1.931 0 O-C-N 121.028 -1.045 . . . . 0.0 109.717 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.796 0 O-C-N 121.527 -0.733 . . . . 0.0 110.304 179.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.586 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.524 1.656 0 O4'-C1'-N19 110.427 3.284 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.586 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.44 1.529 1 O4'-C1'-N19 111.403 4.504 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.539 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.123 0 O4'-C1'-N19 110.783 3.729 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.54 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 P--O5' 1.611 1.767 1 O4'-C1'-N19 111.002 4.002 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.54 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.836 0 O4'-C1'-N19 110.868 3.835 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.446 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.868 0 C3'-C2'-C1' 107.106 3.147 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.901 0 O4'-C1'-N19 110.992 3.99 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.154 0 O4'-C1'-N19 110.589 3.487 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.81 ' C8 ' ' H71' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.441 1.644 1 O4'-C1'-N19 111.139 4.174 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.81 ' H71' ' C8 ' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.322 1 O4'-C1'-N19 112.061 5.326 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.442 ' C4 ' ' N3 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.496 1 O4'-C1'-N19 111.705 4.881 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.529 2.288 0 O4'-C1'-N19 110.303 3.128 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.612 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.507 0 O4'-C1'-N19 110.224 3.03 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.843 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.526 1.849 1 O4'-C1'-N19 112.333 5.666 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.562 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.114 0 O4'-C1'-N19 110.641 3.551 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.493 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.508 1 O4'-C1'-N19 111.015 4.018 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.498 1.965 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -93.39 29.92 1.84 Allowed 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.27 -0.894 . . . . 0.0 109.712 179.514 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.92 130.54 47.5 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 121.235 -0.915 . . . . 0.0 109.303 179.716 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 129.91 -37.9 2.08 Favored Glycine 0 N--CA 1.495 2.625 0 N-CA-C 108.909 -1.676 . . . . 0.0 108.909 -179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.417 ' O ' ' CH2' ' A' ' 18' ' ' TRP . 65.8 m -66.53 89.08 0.14 Allowed 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.362 -1.081 . . . . 0.0 109.264 179.221 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.514 HG23 ' O ' ' A' ' 6' ' ' VAL . 28.7 m -85.15 109.72 18.48 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.477 0 N-CA-C 108.086 -1.079 . . . . 0.0 108.086 179.526 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.523 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 53.9 t -45.17 113.55 0.59 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.338 -0.851 . . . . 0.0 110.266 -178.778 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.4 m -63.23 -6.78 4.81 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.366 -0.833 . . . . 0.0 111.285 -179.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.412 ' CG ' HG11 ' A' ' 27' ' ' VAL . 1.6 m120 -102.9 -31.01 10.47 Favored 'General case' 0 N--CA 1.495 1.821 0 O-C-N 120.795 -1.19 . . . . 0.0 110.728 -179.704 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.623 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 17.7 p -138.19 18.84 2.78 Favored 'General case' 0 N--CA 1.497 1.889 0 O-C-N 120.812 -1.18 . . . . 0.0 111.003 179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER 46.82 25.51 0.46 Allowed 'General case' 0 N--CA 1.505 2.314 0 O-C-N 121.351 -0.843 . . . . 0.0 111.615 179.015 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.426 HG22 ' CB ' ' A' ' 7' ' ' CYS . 5.8 t -88.6 132.53 34.5 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 120.67 -1.268 . . . . 0.0 109.525 179.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 3.1 p -92.68 -6.66 48.77 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.592 -0.693 . . . . 0.0 109.25 179.353 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 42.0 p -112.69 128.86 56.52 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.33 -0.856 . . . . 0.0 109.686 179.95 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.547 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 5.4 p -149.07 152.56 36.42 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.059 -1.025 . . . . 0.0 109.883 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.843 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 19.5 p -83.65 -31.06 26.38 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.6 -0.687 . . . . 0.0 109.461 179.501 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.669 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 24.9 mt -141.48 87.4 2.07 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.392 -0.818 . . . . 0.0 108.873 179.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.547 ' CZ2' HG23 ' A' ' 15' ' ' THR . 11.5 m95 -53.32 103.14 0.07 Allowed 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.247 -0.908 . . . . 0.0 110.357 -179.421 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.504 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 2.3 tpt180 -88.61 83.94 6.75 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.35 -0.844 . . . . 0.0 109.259 179.988 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.8 tpp180 -71.44 114.64 9.72 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.299 -0.876 . . . . 0.0 108.903 179.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 26.4 p -84.01 139.6 39.85 Favored Pre-proline 0 N--CA 1.496 1.836 0 O-C-N 121.178 -0.951 . . . . 0.0 109.573 -179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -55.86 -31.79 82.51 Favored 'Trans proline' 0 C--N 1.319 -1.011 0 C-N-CA 122.589 2.193 . . . . 0.0 111.053 -179.33 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -56.71 -23.81 44.88 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 121.436 -0.79 . . . . 0.0 109.343 179.358 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.11 28.19 3.95 Favored Glycine 0 N--CA 1.496 2.664 0 N-CA-C 109.994 -1.242 . . . . 0.0 109.994 179.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 41.6 m-20 -129.47 99.79 20.65 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 121.052 -1.263 . . . . 0.0 110.14 -179.903 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.472 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 Cg_endo -66.09 108.04 1.25 Allowed 'Trans proline' 0 C--N 1.314 -1.278 0 C-N-CA 122.216 1.944 . . . . 0.0 109.818 178.723 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.523 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.8 m -121.12 125.9 74.47 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 O-C-N 121.109 -0.994 . . . . 0.0 110.351 179.91 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.534 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.9 p -51.4 131.84 29.04 Favored 'General case' 0 N--CA 1.485 1.287 0 O-C-N 121.56 -0.713 . . . . 0.0 109.514 179.468 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.669 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 6.0 t-20 -41.97 -40.37 2.17 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.486 -0.759 . . . . 0.0 111.725 -178.287 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -51.35 -38.43 53.14 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.113 -0.992 . . . . 0.0 109.79 179.678 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.57 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 2.3 m -68.06 -42.22 80.8 Favored 'General case' 0 N--CA 1.498 1.967 0 N-CA-C 108.222 -1.029 . . . . 0.0 108.222 178.301 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.65 -57.04 17.92 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 109.872 -1.291 . . . . 0.0 109.872 179.551 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 30.4 mt -59.71 -42.88 94.06 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.512 -0.993 . . . . 0.0 109.006 179.56 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 37.7 t80 -57.95 -42.58 85.26 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.353 -0.842 . . . . 0.0 109.268 178.894 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.569 ' HB2' ' NE ' ' A' ' 42' ' ' ARG . 41.4 t80 -55.79 -36.3 67.24 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.305 -0.872 . . . . 0.0 110.169 179.644 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 tttt -79.29 -49.93 11.69 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.75 -1.219 . . . . 0.0 110.092 -179.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 5.0 mp -49.34 -33.01 12.4 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.326 -0.859 . . . . 0.0 110.219 -179.447 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.524 ' CB ' HG22 ' A' ' 40' ' ' VAL . 16.3 m-70 -118.3 -6.18 10.82 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.137 -0.977 . . . . 0.0 110.64 -179.983 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.47 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.4 OUTLIER 50.07 34.88 8.9 Favored 'General case' 0 N--CA 1.505 2.316 0 O-C-N 121.096 -1.002 . . . . 0.0 109.937 -179.295 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.524 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.4 m -138.71 -169.11 0.49 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.219 0 O-C-N 121.271 -0.893 . . . . 0.0 109.383 179.754 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -60.81 -176.02 0.05 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.27 -0.894 . . . . 0.0 109.771 179.466 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.57 ' HG2' ' O ' ' A' ' 31' ' ' CYS . 0.2 OUTLIER -135.63 86.26 28.87 Favored Pre-proline 0 N--CA 1.497 1.924 0 O-C-N 121.011 -1.056 . . . . 0.0 110.047 179.886 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.8 Cg_endo -64.79 147.26 89.52 Favored 'Trans proline' 0 C--N 1.314 -1.279 0 C-N-CA 122.367 2.045 . . . . 0.0 110.46 179.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.635 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.7 OUTLIER -91.34 12.78 19.32 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.093 -1.004 . . . . 0.0 110.523 179.661 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.6 p -53.96 -26.12 24.14 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 120.955 -1.091 . . . . 0.0 110.611 179.117 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 8.1 ttp -94.61 -6.65 43.0 Favored 'General case' 0 N--CA 1.498 1.946 0 O-C-N 121.197 -0.939 . . . . 0.0 110.845 -179.832 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.481 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.1 OUTLIER -81.47 162.4 23.29 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 120.931 -1.105 . . . . 0.0 110.395 -179.984 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.534 ' HD2' ' HG3' ' A' ' 52' ' ' GLN . 0.5 OUTLIER -146.18 -173.56 4.21 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.525 -0.734 . . . . 0.0 109.118 179.363 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -72.71 -9.05 58.18 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.383 -0.823 . . . . 0.0 111.598 -179.315 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -141.53 149.74 21.34 Favored Glycine 0 N--CA 1.501 3.026 0 O-C-N 120.53 -1.356 . . . . 0.0 110.727 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.601 HG21 HG22 ' A' ' 16' ' ' THR . 4.7 mt -63.6 131.76 29.26 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.768 0 O-C-N 121.379 -1.071 . . . . 0.0 109.567 179.648 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.534 ' HG3' ' HD2' ' A' ' 48' ' ' LYS . 3.6 mt-30 -63.73 136.85 57.77 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.335 -0.853 . . . . 0.0 110.145 -179.863 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.61 160.67 40.63 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 121.102 -0.999 . . . . 0.0 109.853 179.51 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -152.51 -155.67 0.63 Allowed 'General case' 0 N--CA 1.497 1.889 0 N-CA-C 109.122 -0.695 . . . . 0.0 109.122 179.604 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 6.1 t-20 -56.39 114.96 2.22 Favored 'General case' 0 N--CA 1.497 1.915 0 O-C-N 120.835 -1.165 . . . . 0.0 108.503 178.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.645 ' HD3' " O3'" ' C' ' 125' ' ' ' DT' . 5.3 ttm180 -51.78 143.13 13.59 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.508 -0.745 . . . . 0.0 110.773 -178.757 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 11.3 ttpt -58.22 143.33 44.67 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.503 -0.748 . . . . 0.0 109.529 179.558 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.4 p -50.43 116.25 0.5 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.873 0 N-CA-C 108.847 -0.798 . . . . 0.0 108.847 179.122 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -54.37 104.38 0.11 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.438 -0.788 . . . . 0.0 109.715 -179.075 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.497 1.92 0 O-C-N 121.503 -0.748 . . . . 0.0 110.022 -179.5 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.54 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 2.02 0 C3'-C2'-C1' 106.974 3.053 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.54 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.945 1 O4'-C1'-N19 112.116 5.395 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.634 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.451 1 O4'-C1'-N19 111.22 4.276 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.634 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.001 1 O4'-C1'-N19 111.2 4.25 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.537 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.79 0 O4'-C1'-N19 110.585 3.481 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C1'-N19 110.542 3.428 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.429 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.44 1.556 1 O4'-C1'-N19 111.219 4.273 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.429 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.782 0 O4'-C1'-N19 110.452 3.315 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.577 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.808 0 O4'-C1'-N19 110.599 3.499 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.577 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.579 1 O4'-C1'-N19 111.634 4.793 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.421 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.49 0 O4'-C1'-N19 110.931 3.914 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.442 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.3 0 O4'-C1'-N19 110.845 3.806 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.615 " H2'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.708 1 O4'-C1'-N19 111.053 4.066 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.58 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.529 2.312 1 O4'-C1'-N19 111.815 5.018 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.503 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.465 0 O4'-C1'-N19 110.69 3.613 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.447 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.481 0 O4'-C1'-N19 110.579 3.474 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER . . . . . 0 N--CA 1.495 1.799 0 N-CA-C 109.517 -0.549 . . . . 0.0 109.517 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -87.09 66.76 9.48 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.176 -0.953 . . . . 0.0 109.018 179.638 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.22 146.56 43.18 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.326 -0.859 . . . . 0.0 109.544 -179.797 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 103.27 -31.93 8.16 Favored Glycine 0 N--CA 1.495 2.584 0 N-CA-C 108.862 -1.695 . . . . 0.0 108.862 -178.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.503 HG23 ' CB ' ' A' ' 26' ' ' PRO . 55.1 m -66.59 93.97 0.27 Allowed 'General case' 0 N--CA 1.494 1.756 0 O-C-N 121.284 -1.127 . . . . 0.0 109.917 179.592 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 24.6 m -100.14 138.73 23.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 N-CA-C 108.071 -1.085 . . . . 0.0 108.071 178.981 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.935 ' HB2' HG22 ' A' ' 12' ' ' THR . 12.2 t -58.18 118.79 5.85 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.256 -0.902 . . . . 0.0 110.478 -179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.2 m -64.11 -12.75 42.36 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.245 -0.909 . . . . 0.0 110.153 179.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.3 m-80 -105.04 -25.46 12.53 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.183 -0.948 . . . . 0.0 110.855 -179.661 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.567 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 7.5 p -147.9 28.05 0.95 Allowed 'General case' 0 N--CA 1.502 2.167 0 O-C-N 120.657 -1.277 . . . . 0.0 111.12 -179.821 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 30.69 40.56 0.01 OUTLIER 'General case' 0 N--CA 1.513 2.688 0 N-CA-C 113.029 0.751 . . . . 0.0 113.029 178.676 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.935 HG22 ' HB2' ' A' ' 7' ' ' CYS . 12.2 t -90.44 139.7 30.43 Favored 'General case' 0 N--CA 1.489 1.513 0 O-C-N 120.976 -1.077 . . . . 0.0 108.96 178.833 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.2 p -99.0 -24.97 14.72 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.946 -1.096 . . . . 0.0 109.493 -179.889 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.8 p -101.25 116.06 31.93 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.494 -0.754 . . . . 0.0 109.232 179.761 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.425 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 6.2 p -138.49 154.93 48.82 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.028 -1.045 . . . . 0.0 110.037 -179.597 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.615 HG21 " H2'" ' C' ' 124' ' ' ' DA' . 40.9 p -74.87 -31.33 61.59 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.711 -0.848 . . . . 0.0 108.711 179.149 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.519 ' HA ' HD23 ' A' ' 17' ' ' LEU . 8.8 mt -153.94 125.01 7.32 Favored 'General case' 0 N--CA 1.493 1.723 0 N-CA-C 108.821 -0.807 . . . . 0.0 108.821 179.034 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 13.6 m95 -82.04 106.51 14.01 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.628 -0.67 . . . . 0.0 109.979 -179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.546 ' HB2' ' O ' ' A' ' 27' ' ' VAL . 0.2 OUTLIER -80.91 77.45 7.79 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.071 -1.018 . . . . 0.0 108.985 179.43 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.449 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 18.3 tpt180 -61.29 99.62 0.11 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 179.905 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.559 ' HB3' ' HB2' ' A' ' 25' ' ' ASP . 0.1 OUTLIER -60.21 152.03 64.61 Favored Pre-proline 0 N--CA 1.5 2.026 0 O-C-N 121.395 -0.816 . . . . 0.0 109.545 -179.421 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -54.17 -44.21 51.4 Favored 'Trans proline' 0 C--N 1.318 -1.032 0 C-N-CA 122.645 2.23 . . . . 0.0 110.809 -179.528 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -64.04 -19.08 64.95 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.255 -0.903 . . . . 0.0 109.731 179.252 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.02 41.63 1.16 Allowed Glycine 0 N--CA 1.496 2.678 0 N-CA-C 109.92 -1.272 . . . . 0.0 109.92 179.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.559 ' HB2' ' HB3' ' A' ' 21' ' ' SER . 51.1 m-20 -120.02 96.25 49.32 Favored Pre-proline 0 N--CA 1.495 1.807 0 O-C-N 121.274 -1.133 . . . . 0.0 110.196 -179.744 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.503 ' CB ' HG23 ' A' ' 5' ' ' THR . 1.3 Cg_endo -68.22 96.44 0.47 Allowed 'Trans proline' 0 C--N 1.312 -1.358 0 C-N-CA 122.155 1.904 . . . . 0.0 109.838 179.04 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.546 ' O ' ' HB2' ' A' ' 19' ' ' ARG . 2.0 m -111.45 122.71 66.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.073 0 O-C-N 121.064 -1.022 . . . . 0.0 110.549 -179.837 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.425 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 4.2 p -45.51 129.87 8.63 Favored 'General case' 0 N--CA 1.489 1.479 0 O-C-N 121.5 -0.75 . . . . 0.0 110.125 179.547 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -32.35 -51.37 0.26 Allowed 'General case' 0 N--CA 1.507 2.424 0 N-CA-C 112.743 0.645 . . . . 0.0 112.743 -178.245 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.54 -47.85 27.84 Favored 'General case' 0 N--CA 1.503 2.186 0 O-C-N 121.313 -0.867 . . . . 0.0 111.128 -179.206 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.462 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 14.8 m -60.05 -45.79 91.67 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.381 -0.824 . . . . 0.0 108.87 179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.85 -50.17 70.59 Favored Glycine 0 N--CA 1.493 2.463 0 N-CA-C 110.229 -1.148 . . . . 0.0 110.229 179.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.424 HD13 ' C7 ' ' C' ' 123' ' ' ' DT' . 90.7 mt -63.9 -62.11 1.85 Allowed 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.369 -1.077 . . . . 0.0 110.359 -179.448 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.556 ' CD1' ' HB2' ' A' ' 42' ' ' ARG . 21.0 t80 -51.67 -44.15 62.96 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.317 -0.864 . . . . 0.0 109.177 179.662 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.475 ' O ' ' N ' ' A' ' 39' ' ' GLN . 23.4 t80 -50.81 -48.48 59.72 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.573 -0.705 . . . . 0.0 109.41 179.363 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -65.22 -37.98 88.98 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.043 -1.035 . . . . 0.0 110.657 -179.862 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.421 HD13 ' HA ' ' A' ' 34' ' ' TYR . 7.5 mp -46.19 -53.97 9.56 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.05 -1.031 . . . . 0.0 110.008 -179.618 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.524 ' CB ' HG22 ' A' ' 40' ' ' VAL . 88.1 m-70 -112.05 10.15 20.38 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.268 -0.895 . . . . 0.0 109.73 179.045 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.475 ' N ' ' O ' ' A' ' 35' ' ' TYR . 2.5 tt0 47.62 35.12 4.1 Favored 'General case' 0 N--CA 1.501 2.112 0 O-C-N 121.4 -0.813 . . . . 0.0 110.136 -178.679 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.524 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.7 m -132.94 -177.9 2.38 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 O-C-N 121.517 -0.74 . . . . 0.0 109.385 179.637 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 52.9 p-10 -75.59 179.47 5.32 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.278 -0.889 . . . . 0.0 110.661 179.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.556 ' HB2' ' CD1' ' A' ' 34' ' ' TYR . 10.0 ttp180 -150.19 132.62 8.08 Favored Pre-proline 0 N--CA 1.498 1.957 0 O-C-N 121.198 -0.939 . . . . 0.0 109.787 179.921 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.421 ' HD2' ' HG2' ' A' ' 42' ' ' ARG . 1.2 Cg_endo -63.79 149.36 90.92 Favored 'Trans proline' 0 C--N 1.316 -1.154 0 C-N-CA 122.155 1.904 . . . . 0.0 110.657 179.548 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.567 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 1.1 pp -85.98 -1.47 57.36 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.02 -1.05 . . . . 0.0 110.245 179.559 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 6.2 t -61.3 -11.39 9.61 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.119 -0.988 . . . . 0.0 110.856 179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.19 -7.36 48.54 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 120.782 -1.198 . . . . 0.0 110.694 179.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.595 ' HD3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -74.18 172.92 10.89 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.556 -1.34 . . . . 0.0 110.253 179.946 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.403 ' HG3' ' N ' ' A' ' 49' ' ' ASP . 1.9 tppp? -136.61 163.98 29.29 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.25 -0.906 . . . . 0.0 109.3 -179.698 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.403 ' N ' ' HG3' ' A' ' 48' ' ' LYS . 6.4 t70 -49.09 -80.46 0.01 OUTLIER 'General case' 0 N--CA 1.502 2.14 0 O-C-N 121.478 -0.764 . . . . 0.0 110.351 -179.802 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.85 161.96 26.1 Favored Glycine 0 N--CA 1.497 2.762 0 N-CA-C 109.235 -1.546 . . . . 0.0 109.235 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.492 ' CG2' HG22 ' A' ' 16' ' ' THR . 5.4 mt -57.06 126.58 14.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.291 -1.123 . . . . 0.0 109.737 -179.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.446 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -69.15 154.23 42.39 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.498 -0.751 . . . . 0.0 109.58 179.749 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.438 ' HB ' ' OP1' ' C' ' 125' ' ' ' DT' . 0.0 OUTLIER -156.19 162.41 40.19 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.166 -0.959 . . . . 0.0 109.515 179.016 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.405 ' HD2' ' HA ' ' A' ' 54' ' ' ARG . 5.6 mmm180 -150.88 -172.61 4.25 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 121.54 -0.725 . . . . 0.0 110.421 -179.661 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -72.19 79.53 0.97 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.13 -0.981 . . . . 0.0 109.562 179.6 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.47 ' HD2' " O3'" ' C' ' 125' ' ' ' DT' . 0.0 OUTLIER -58.58 162.2 4.04 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.604 -0.685 . . . . 0.0 110.41 -179.689 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 14.8 pttt -57.54 164.5 1.94 Allowed 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.442 -0.786 . . . . 0.0 109.919 179.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 6.2 m -68.65 162.57 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 O-C-N 121.015 -1.053 . . . . 0.0 109.714 179.923 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 4.9 m -81.31 90.38 6.13 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.169 -0.957 . . . . 0.0 108.711 179.055 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.6 t . . . . . 0 N--CA 1.499 2.007 0 O-C-N 121.55 -0.719 . . . . 0.0 110.253 -179.053 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.529 ' C6 ' ' C6 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.688 0 O4'-C1'-N19 110.556 3.444 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.662 ' O6 ' HD13 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.526 1.821 1 O4'-C1'-N19 111.243 4.303 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.609 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.292 1 O4'-C1'-N19 111.231 4.289 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.609 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.285 0 O4'-C1'-N19 110.953 3.942 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.502 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.693 0 O4'-C1'-N19 110.499 3.374 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.438 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.441 1.614 0 O4'-C1'-N19 110.659 3.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.438 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.707 0 O4'-C1'-N19 110.89 3.862 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.418 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.879 0 O4'-C1'-N19 110.461 3.327 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.704 ' C8 ' ' H71' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 P--O5' 1.61 1.668 1 O4'-C1'-N19 111.326 4.407 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.704 ' H71' ' C8 ' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.625 1 O4'-C1'-N19 112.032 5.29 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.42 ' C5 ' ' C2 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.766 1 O4'-C1'-N19 112.106 5.382 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.537 ' H71' ' HB3' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.531 2.509 0 O4'-C1'-N19 110.416 3.27 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.623 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.535 2.974 0 O4'-C1'-N19 110.82 3.775 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.608 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.204 1 O4'-C1'-N19 112.331 5.664 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.608 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.535 0 O4'-C1'-N19 110.766 3.708 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.463 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.53 2.408 0 O4'-C1'-N19 110.991 3.988 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.5 2.037 0 CA-C-O 120.49 0.186 . . . . 0.0 110.562 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -50.43 -31.3 14.7 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 121.052 -1.03 . . . . 0.0 110.036 179.918 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -57.66 119.93 7.46 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.257 -0.902 . . . . 0.0 108.954 178.853 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.484 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 130.38 -26.67 4.1 Favored Glycine 0 N--CA 1.495 2.624 0 N-CA-C 109.275 -1.53 . . . . 0.0 109.275 -179.101 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.541 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 98.5 m -59.46 91.7 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.277 -1.131 . . . . 0.0 109.349 179.364 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.586 HG23 ' O ' ' A' ' 6' ' ' VAL . 21.0 m -83.91 111.0 19.26 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.531 0 O-C-N 121.049 -1.032 . . . . 0.0 108.261 179.96 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.487 ' CB ' HG22 ' A' ' 12' ' ' THR . 40.8 t -48.24 109.5 0.24 Allowed 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.438 -0.789 . . . . 0.0 110.158 -178.733 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.6 m -58.29 -12.15 3.42 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.43 -0.794 . . . . 0.0 111.368 -179.598 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.477 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 0.9 OUTLIER -96.16 -30.67 13.38 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 120.965 -1.084 . . . . 0.0 110.793 -179.68 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.594 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 17.4 p -141.03 19.3 2.28 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 120.661 -1.274 . . . . 0.0 111.41 -179.89 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER 47.5 25.61 0.66 Allowed 'General case' 0 N--CA 1.505 2.321 0 O-C-N 121.321 -0.862 . . . . 0.0 111.768 179.199 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.487 HG22 ' CB ' ' A' ' 7' ' ' CYS . 8.1 t -87.49 132.96 33.84 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 120.81 -1.181 . . . . 0.0 109.816 179.36 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 94.8 p -90.24 -23.15 21.32 Favored 'General case' 0 N--CA 1.495 1.778 0 N-CA-C 109.032 -0.729 . . . . 0.0 109.032 179.313 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 15.3 p -98.99 130.91 45.36 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.61 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 12.9 p -148.82 138.44 21.92 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.271 -0.893 . . . . 0.0 109.646 179.887 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.623 HG21 " H3'" ' C' ' 124' ' ' ' DA' . 2.5 p -64.15 -34.87 79.05 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.644 -0.873 . . . . 0.0 108.644 179.216 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.662 HD13 ' O6 ' ' B' ' 107' ' ' ' DG' . 46.7 mt -144.48 104.78 4.1 Favored 'General case' 0 N--CA 1.489 1.489 0 CA-C-O 121.401 0.62 . . . . 0.0 109.5 179.692 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.61 ' CZ3' HG21 ' A' ' 15' ' ' THR . 6.5 m95 -62.56 99.93 0.17 Allowed 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.191 -0.943 . . . . 0.0 109.85 179.681 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.478 ' HB3' ' O ' ' A' ' 27' ' ' VAL . 0.0 OUTLIER -83.94 82.08 8.5 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.395 -0.815 . . . . 0.0 108.954 179.568 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.443 ' NH1' ' HG3' ' A' ' 26' ' ' PRO . 4.1 tpp180 -63.06 96.14 0.09 Allowed 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.289 -1.004 . . . . 0.0 108.289 179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 1.7 t -58.81 133.6 86.64 Favored Pre-proline 0 N--CA 1.495 1.798 0 O-C-N 121.385 -0.822 . . . . 0.0 110.289 -178.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -56.4 -33.08 91.0 Favored 'Trans proline' 0 C--N 1.317 -1.129 0 C-N-CA 122.517 2.145 . . . . 0.0 110.556 -179.805 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.71 -23.91 31.58 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.386 -0.821 . . . . 0.0 109.767 178.834 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 115.49 26.95 3.24 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 110.448 -1.061 . . . . 0.0 110.448 179.577 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 51.0 m-20 -132.63 112.39 13.86 Favored Pre-proline 0 N--CA 1.495 1.82 0 O-C-N 120.959 -1.318 . . . . 0.0 110.408 179.901 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.541 ' HB2' ' CG2' ' A' ' 5' ' ' THR . 1.1 Cg_endo -67.95 105.95 1.24 Allowed 'Trans proline' 0 C--N 1.313 -1.321 0 C-N-CA 122.09 1.86 . . . . 0.0 109.474 178.442 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.478 ' O ' ' HB3' ' A' ' 19' ' ' ARG . 2.1 m -121.56 127.27 75.57 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.086 -1.009 . . . . 0.0 110.246 -179.862 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.494 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.4 p -48.98 132.28 18.71 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.457 -0.777 . . . . 0.0 109.09 179.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.61 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.8 t-20 -35.7 -48.09 0.52 Allowed 'General case' 0 N--CA 1.508 2.433 0 O-C-N 121.685 -0.634 . . . . 0.0 111.761 -178.083 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -45.42 -51.67 11.1 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.346 -0.847 . . . . 0.0 110.9 -179.888 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.477 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 32.8 m -61.28 -47.99 83.44 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.395 -0.816 . . . . 0.0 109.243 179.46 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.07 -33.56 75.06 Favored Glycine 0 N--CA 1.497 2.75 0 N-CA-C 110.841 -0.903 . . . . 0.0 110.841 -179.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.537 ' HB3' ' H71' ' C' ' 123' ' ' ' DT' . 68.0 mt -74.16 -62.45 1.51 Allowed 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.252 -1.146 . . . . 0.0 110.19 -179.294 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.634 ' HA ' HD22 ' A' ' 37' ' ' LEU . 25.0 t80 -55.52 -40.66 72.07 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.102 -0.999 . . . . 0.0 108.917 179.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.467 ' O ' ' N ' ' A' ' 39' ' ' GLN . 40.9 t80 -54.89 -46.13 74.77 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.434 -0.791 . . . . 0.0 109.675 179.414 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.9 tttt -61.36 -32.85 72.76 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 120.761 -1.212 . . . . 0.0 110.3 179.71 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.634 HD22 ' HA ' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -57.95 -62.13 2.03 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.214 -0.928 . . . . 0.0 110.863 -179.338 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.499 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 47.0 m-70 -105.0 9.8 34.34 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.011 -1.056 . . . . 0.0 110.364 -179.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.499 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.3 OUTLIER 50.05 27.47 2.51 Favored 'General case' 0 N--CA 1.505 2.303 0 CA-C-O 121.589 0.709 . . . . 0.0 110.685 -179.117 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.498 HG22 ' CB ' ' A' ' 38' ' ' HIS . 6.2 m -130.94 160.95 41.78 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.251 0 O-C-N 121.237 -0.914 . . . . 0.0 110.19 179.75 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.5 p-10 -79.87 162.49 24.99 Favored 'General case' 0 N--CA 1.496 1.87 0 CA-C-O 121.371 0.605 . . . . 0.0 110.101 179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.487 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -145.98 150.49 42.51 Favored Pre-proline 0 N--CA 1.495 1.791 0 O-C-N 121.298 -0.876 . . . . 0.0 109.954 179.509 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.8 Cg_exo -59.11 146.77 93.27 Favored 'Trans proline' 0 C--N 1.315 -1.213 0 C-N-CA 122.534 2.156 . . . . 0.0 111.031 -179.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.594 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -83.93 37.21 0.59 Allowed 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.297 -0.877 . . . . 0.0 110.865 -179.866 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 25.0 p -68.14 -8.38 38.02 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.007 -1.058 . . . . 0.0 110.293 178.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 3.3 mmm -93.0 -20.26 20.76 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.11 -0.994 . . . . 0.0 110.304 -179.925 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.548 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -66.77 142.68 57.29 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 120.88 -1.137 . . . . 0.0 109.614 179.986 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 12.7 mttt -131.59 -155.42 0.69 Allowed 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.35 -0.844 . . . . 0.0 109.53 -179.334 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -57.15 -84.85 0.01 OUTLIER 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.453 -0.779 . . . . 0.0 110.644 -179.697 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -110.52 170.45 14.02 Favored Glycine 0 N--CA 1.494 2.541 0 N-CA-C 109.281 -1.527 . . . . 0.0 109.281 179.934 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.565 ' CG2' HG23 ' A' ' 16' ' ' THR . 5.3 mt -52.6 130.15 13.47 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 O-C-N 121.259 -1.142 . . . . 0.0 110.256 -179.829 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.2 OUTLIER -74.48 165.69 24.78 Favored 'General case' 0 N--CA 1.49 1.554 0 CA-C-O 121.496 0.665 . . . . 0.0 109.545 179.282 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -149.88 166.52 29.29 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.292 -0.88 . . . . 0.0 109.287 179.717 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.67 -168.05 3.0 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.509 -0.744 . . . . 0.0 109.749 -179.825 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.5 OUTLIER -74.72 113.02 11.51 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.103 -0.998 . . . . 0.0 108.835 179.365 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.486 ' HD3' ' OP1' ' C' ' 126' ' ' ' DC' . 2.7 ttp180 -51.43 151.69 2.94 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.451 -0.781 . . . . 0.0 109.964 -179.209 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.453 ' N ' ' HG3' ' A' ' 56' ' ' ARG . 0.1 OUTLIER -79.96 136.45 36.63 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 179.379 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 6.4 p -51.66 146.04 1.99 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 O-C-N 121.307 -0.871 . . . . 0.0 108.901 179.436 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 6.8 p -48.29 100.51 0.02 OUTLIER 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.178 -0.951 . . . . 0.0 109.472 -179.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER . . . . . 0 N--CA 1.501 2.088 0 O-C-N 121.755 -0.591 . . . . 0.0 110.74 -178.636 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.579 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.611 1.79 0 O4'-C1'-N19 110.44 3.3 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.579 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.778 1 O4'-C1'-N19 111.763 4.954 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.554 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.091 1 O4'-C1'-N19 111.238 4.298 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.564 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.052 1 O4'-C1'-N19 111.051 4.064 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.564 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.612 1.873 0 O4'-C1'-N19 110.655 3.568 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.525 1.787 0 O4'-C1'-N19 110.461 3.326 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.425 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.523 1.558 1 O4'-C1'-N19 111.118 4.148 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.425 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.442 1.694 0 O4'-C1'-N19 110.351 3.189 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.564 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.808 0 O4'-C1'-N19 110.669 3.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.564 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.401 1 O4'-C1'-N19 111.734 4.918 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.481 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.453 0 O4'-C1'-N19 110.977 3.971 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.568 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.143 0 O4'-C1'-N19 110.814 3.767 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.568 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.321 0 O4'-C1'-N19 110.656 3.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.593 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.524 1.663 1 O4'-C1'-N19 112.207 5.509 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.591 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.93 0 O4'-C1'-N19 110.662 3.577 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.478 ' C6 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.135 1 O4'-C1'-N19 111.064 4.08 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.8 ttpp . . . . . 0 N--CA 1.497 1.889 0 N-CA-C 110.063 -0.347 . . . . 0.0 110.063 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 1.4 mmt180 -85.76 54.01 2.98 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 120.867 -1.146 . . . . 0.0 110.052 179.948 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -60.08 157.59 12.72 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.143 -0.973 . . . . 0.0 109.291 179.652 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 101.07 -46.66 1.28 Allowed Glycine 0 N--CA 1.491 2.348 0 N-CA-C 108.635 -1.786 . . . . 0.0 108.635 -178.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.476 HG22 ' CH2' ' A' ' 18' ' ' TRP . 53.1 m -83.13 93.38 7.62 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.137 -1.213 . . . . 0.0 108.844 178.797 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.6 m -98.21 121.13 48.42 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 N-CA-C 108.388 -0.967 . . . . 0.0 108.388 179.717 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.521 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 46.5 t -50.22 113.56 0.9 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.374 -0.829 . . . . 0.0 110.151 -179.264 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 37.6 m -62.95 -11.84 21.44 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.139 -0.976 . . . . 0.0 111.112 -179.637 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.478 ' OD1' HG11 ' A' ' 27' ' ' VAL . 6.5 m-20 -95.53 -31.68 13.21 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.911 -1.118 . . . . 0.0 110.747 -179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.517 ' SG ' HG22 ' A' ' 12' ' ' THR . 16.4 p -139.5 18.33 2.55 Favored 'General case' 0 N--CA 1.504 2.227 0 O-C-N 120.781 -1.199 . . . . 0.0 110.946 179.821 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.441 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 48.18 24.93 0.73 Allowed 'General case' 0 N--CA 1.505 2.277 0 O-C-N 121.269 -0.894 . . . . 0.0 112.246 178.815 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.517 HG22 ' SG ' ' A' ' 10' ' ' CYS . 14.6 t -87.35 135.18 33.42 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.602 -1.312 . . . . 0.0 110.061 179.521 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.4 p -90.13 -16.14 30.18 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.487 -0.758 . . . . 0.0 109.145 179.122 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 44.9 p -102.92 129.56 49.68 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.289 -0.882 . . . . 0.0 108.713 179.489 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.564 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 7.0 p -146.36 148.76 32.69 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.204 -0.935 . . . . 0.0 110.092 -179.483 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.593 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 32.8 p -72.03 -37.25 69.78 Favored 'General case' 0 N--CA 1.49 1.53 0 N-CA-C 108.709 -0.848 . . . . 0.0 108.709 179.077 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.487 ' HA ' HD23 ' A' ' 17' ' ' LEU . 10.3 mt -147.07 105.55 3.8 Favored 'General case' 0 N--CA 1.496 1.871 0 N-CA-C 108.502 -0.925 . . . . 0.0 108.502 178.237 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.564 ' CZ3' HG21 ' A' ' 15' ' ' THR . 11.4 m95 -59.51 98.62 0.05 OUTLIER 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.466 -0.771 . . . . 0.0 110.306 -179.146 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.67 75.91 3.34 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.326 -0.859 . . . . 0.0 108.784 179.337 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.415 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.08 94.75 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.682 -0.858 . . . . 0.0 108.682 179.881 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.4 139.97 96.52 Favored Pre-proline 0 N--CA 1.499 1.992 0 O-C-N 121.44 -0.788 . . . . 0.0 110.429 -178.641 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -53.98 -39.15 86.18 Favored 'Trans proline' 0 C--N 1.319 -0.992 0 C-N-CA 122.832 2.355 . . . . 0.0 111.184 -179.225 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.9 -22.43 48.44 Favored 'General case' 0 N--CA 1.497 1.921 0 O-C-N 121.273 -0.892 . . . . 0.0 109.69 179.193 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.77 32.81 2.57 Favored Glycine 0 N--CA 1.498 2.77 0 N-CA-C 110.002 -1.239 . . . . 0.0 110.002 179.813 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 54.2 m-20 -128.04 98.13 27.79 Favored Pre-proline 0 N--CA 1.493 1.722 0 O-C-N 121.167 -1.196 . . . . 0.0 110.076 -179.864 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.521 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.1 Cg_endo -65.08 112.88 2.18 Favored 'Trans proline' 0 C--N 1.312 -1.381 0 C-N-CA 122.26 1.973 . . . . 0.0 110.191 179.153 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.478 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.2 m -124.28 131.2 73.17 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.151 -0.968 . . . . 0.0 109.953 179.51 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.497 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 6.1 p -53.67 134.73 41.62 Favored 'General case' 0 N--CA 1.484 1.257 0 CA-C-O 121.43 0.633 . . . . 0.0 109.763 -179.991 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 2.7 t-20 -36.87 -44.73 0.51 Allowed 'General case' 0 N--CA 1.506 2.366 0 O-C-N 121.724 -0.61 . . . . 0.0 112.075 -178.455 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.79 -47.81 59.64 Favored 'General case' 0 N--CA 1.498 1.975 0 O-C-N 121.331 -0.855 . . . . 0.0 110.187 179.847 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.414 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 55.9 m -68.36 -39.51 81.79 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 121.143 -0.973 . . . . 0.0 109.116 179.1 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -56.07 -36.91 69.25 Favored Glycine 0 N--CA 1.497 2.751 0 N-CA-C 110.254 -1.138 . . . . 0.0 110.254 179.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . . . . . . . . . 61.8 mt -80.17 -58.29 3.22 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.312 -1.11 . . . . 0.0 110.107 -179.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.579 ' CE1' ' HG3' ' A' ' 42' ' ' ARG . 23.6 t80 -51.61 -36.69 46.75 Favored 'General case' 0 N--CA 1.498 1.956 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.703 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.541 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 17.9 t80 -59.79 -51.7 68.61 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 121.312 -0.867 . . . . 0.0 109.56 179.418 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -52.75 -26.15 13.3 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 120.664 -1.273 . . . . 0.0 110.353 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 10.4 mp -72.45 -66.33 0.67 Allowed 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.961 -1.087 . . . . 0.0 110.381 179.94 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.45 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 77.5 m-70 -94.6 -26.57 16.31 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.992 -1.067 . . . . 0.0 110.797 -179.503 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.541 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 75.56 25.53 1.21 Allowed 'General case' 0 N--CA 1.503 2.224 0 CA-C-O 121.588 0.709 . . . . 0.0 111.374 -179.851 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 3.2 m -124.63 167.02 19.21 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.547 0 O-C-N 120.941 -1.099 . . . . 0.0 110.431 179.049 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 9.6 p-10 -85.66 131.13 34.4 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.333 -0.854 . . . . 0.0 109.417 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.579 ' HG3' ' CE1' ' A' ' 34' ' ' TYR . 25.3 mmt180 -109.16 149.13 39.29 Favored Pre-proline 0 N--CA 1.494 1.77 0 O-C-N 121.088 -1.008 . . . . 0.0 110.325 -179.815 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -62.07 150.9 84.78 Favored 'Trans proline' 0 C--N 1.314 -1.263 0 C-N-CA 122.372 2.048 . . . . 0.0 110.431 179.586 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.617 HD13 ' CZ ' ' A' ' 47' ' ' ARG . 0.7 OUTLIER -74.33 29.83 0.08 Allowed 'General case' 0 N--CA 1.501 2.099 0 O-C-N 121.187 -0.946 . . . . 0.0 111.231 179.83 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.7 p -67.97 -17.97 64.59 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.458 -1.401 . . . . 0.0 109.483 178.987 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.52 2.73 52.71 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.392 -0.818 . . . . 0.0 109.929 179.28 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.617 ' CZ ' HD13 ' A' ' 44' ' ' LEU . 3.0 ttp180 -67.39 173.11 4.24 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 120.897 -1.127 . . . . 0.0 109.51 179.897 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -152.76 164.85 37.0 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.165 -0.96 . . . . 0.0 109.773 179.706 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.0 t70 -44.43 -70.25 0.11 Allowed 'General case' 0 N--CA 1.504 2.236 0 CA-C-O 121.419 0.628 . . . . 0.0 109.626 179.579 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -121.38 175.16 16.12 Favored Glycine 0 N--CA 1.494 2.527 0 N-CA-C 108.632 -1.787 . . . . 0.0 108.632 179.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.524 HD11 ' O ' ' A' ' 15' ' ' THR . 4.8 mt -51.39 124.73 4.2 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.718 0 O-C-N 121.277 -1.131 . . . . 0.0 109.706 179.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.518 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -70.27 160.63 31.84 Favored 'General case' 0 N--CA 1.488 1.451 0 O-C-N 121.306 -0.871 . . . . 0.0 108.654 179.238 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.404 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -155.95 165.54 36.16 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.085 -1.01 . . . . 0.0 108.996 179.478 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -143.55 -178.33 5.84 Favored 'General case' 0 N--CA 1.496 1.834 0 O-C-N 121.213 -0.929 . . . . 0.0 109.523 -179.627 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 5.3 t30 -52.15 123.67 11.18 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.31 -0.869 . . . . 0.0 108.722 179.272 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.7 mmt180 -48.41 113.48 0.76 Allowed 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.61 -0.682 . . . . 0.0 109.43 -179.565 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.427 ' O ' ' C ' ' A' ' 58' ' ' VAL . 24.2 ttpt -46.45 120.82 3.06 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.572 -0.705 . . . . 0.0 109.201 -179.622 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.427 ' C ' ' O ' ' A' ' 57' ' ' LYS . 1.1 p -39.53 122.1 0.23 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 179.972 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.6 t -44.83 103.72 0.04 OUTLIER 'General case' 0 N--CA 1.499 2.01 0 N-CA-C 108.954 -0.758 . . . . 0.0 108.954 -179.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 53.4 p . . . . . 0 N--CA 1.491 1.599 0 CA-C-O 121.453 0.644 . . . . 0.0 110.232 -178.371 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.537 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.525 1.799 0 O4'-C1'-N19 110.518 3.397 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.957 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 P--O5' 1.609 1.584 1 O4'-C1'-N19 111.621 4.776 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.591 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.562 1 O4'-C1'-N19 111.119 4.149 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.591 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.483 1 O4'-C1'-N19 111.004 4.005 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.539 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.831 0 O4'-C1'-N19 110.875 3.844 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.435 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.707 0 O4'-C1'-N19 110.604 3.505 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.435 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.764 0 O4'-C1'-N19 110.781 3.726 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.427 ' N4 ' ' C5 ' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.745 0 O4'-C1'-N19 110.429 3.286 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.614 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.58 1 O4'-C1'-N19 111.248 4.31 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.614 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.458 1 O4'-C1'-N19 112.059 5.324 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.542 " O3'" ' HE1' ' A' ' 46' ' ' MET . . . . . . . . 0 C5'--C4' 1.526 1.931 0 O4'-C1'-N19 110.95 3.937 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.145 0 O4'-C1'-N19 110.633 3.542 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.583 ' H62' HD11 ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.532 2.61 0 O4'-C1'-N19 110.737 3.672 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.73 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.557 1 O4'-C1'-N19 112.942 6.427 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.488 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.534 2.876 1 O4'-C1'-N19 111.284 4.355 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.426 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.533 2.691 1 O4'-C1'-N19 111.185 4.231 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 24.9 mtpt . . . . . 0 N--CA 1.497 1.897 0 N-CA-C 109.389 -0.597 . . . . 0.0 109.389 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -82.45 -43.63 17.03 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.484 -0.76 . . . . 0.0 109.06 179.898 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.99 111.04 0.92 Allowed 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.714 -0.616 . . . . 0.0 109.429 179.323 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 115.23 -24.35 10.67 Favored Glycine 0 N--CA 1.496 2.687 0 N-CA-C 110.05 -1.22 . . . . 0.0 110.05 -179.48 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.495 HG23 ' HB2' ' A' ' 26' ' ' PRO . 30.7 m -71.96 92.38 1.27 Allowed 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.873 -1.369 . . . . 0.0 109.309 179.543 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.6 m -93.54 117.03 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.639 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 179.595 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.51 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 44.7 t -45.51 112.37 0.45 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.446 -0.784 . . . . 0.0 110.409 -178.99 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 39.4 m -62.5 -8.94 7.09 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.429 -0.795 . . . . 0.0 111.305 -179.662 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.8 m-80 -104.96 -26.69 12.07 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 120.797 -1.189 . . . . 0.0 111.199 -179.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.603 ' HA ' ' HB3' ' A' ' 44' ' ' LEU . 13.1 p -139.67 17.14 2.52 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.693 -1.254 . . . . 0.0 111.334 179.426 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 16.0 mt-30 49.55 22.13 0.71 Allowed 'General case' 0 N--CA 1.509 2.512 0 O-C-N 121.237 -0.914 . . . . 0.0 111.995 178.723 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.537 ' HB ' ' SG ' ' A' ' 10' ' ' CYS . 2.0 t -90.04 125.48 35.42 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.799 -1.188 . . . . 0.0 109.473 -179.617 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 78.4 p -88.95 -21.66 23.46 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.377 -0.827 . . . . 0.0 109.38 -179.691 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 38.4 p -89.52 117.21 28.26 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.359 -0.838 . . . . 0.0 109.001 179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.63 HG21 ' CH2' ' A' ' 18' ' ' TRP . 6.3 p -144.86 147.51 32.9 Favored 'General case' 0 N--CA 1.496 1.866 0 O-C-N 120.923 -1.111 . . . . 0.0 110.475 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.73 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 77.0 p -80.05 -30.37 39.4 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.541 -0.724 . . . . 0.0 109.08 179.265 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.957 HD11 ' O6 ' ' B' ' 107' ' ' ' DG' . 12.9 mt -144.45 112.02 6.12 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.184 -0.947 . . . . 0.0 109.312 179.411 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.63 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.5 m95 -74.67 90.9 2.32 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.107 -0.995 . . . . 0.0 109.749 -179.83 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -77.15 83.08 3.64 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.384 -0.822 . . . . 0.0 109.377 179.932 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.461 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.6 mmt180 -66.41 110.05 2.96 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.151 -0.968 . . . . 0.0 109.348 -179.89 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 83.1 p -71.03 149.24 94.74 Favored Pre-proline 0 N--CA 1.497 1.89 0 O-C-N 121.212 -0.93 . . . . 0.0 109.465 -179.827 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -56.11 -22.34 39.24 Favored 'Trans proline' 0 C--N 1.319 -1.006 0 C-N-CA 122.432 2.088 . . . . 0.0 111.229 -179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.4 OUTLIER -75.23 -3.43 33.12 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.196 -0.94 . . . . 0.0 110.169 179.203 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.9 34.41 9.0 Favored Glycine 0 N--CA 1.495 2.597 0 N-CA-C 109.408 -1.477 . . . . 0.0 109.408 -179.697 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -127.47 101.4 24.53 Favored Pre-proline 0 N--CA 1.494 1.741 0 O-C-N 121.458 -1.025 . . . . 0.0 110.43 -179.378 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.51 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.3 Cg_endo -65.37 105.02 0.68 Allowed 'Trans proline' 0 C--N 1.315 -1.22 0 C-N-CA 122.593 2.195 . . . . 0.0 110.099 178.781 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.499 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -114.74 124.98 71.93 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.888 0 O-C-N 121.131 -0.981 . . . . 0.0 110.418 179.941 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.489 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.0 p -49.19 131.2 19.7 Favored 'General case' 0 N--CA 1.485 1.301 0 CA-C-O 121.459 0.647 . . . . 0.0 110.074 179.794 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.665 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 23.5 t-20 -37.18 -48.84 0.87 Allowed 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.629 -0.669 . . . . 0.0 111.548 -178.96 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -45.04 -44.08 9.86 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.425 -0.797 . . . . 0.0 110.296 179.988 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.525 ' HB3' ' HD3' ' A' ' 42' ' ' ARG . 3.4 m -64.03 -44.79 91.46 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.749 -0.834 . . . . 0.0 108.749 178.866 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.29 -33.24 85.46 Favored Glycine 0 N--CA 1.494 2.566 0 N-CA-C 110.343 -1.103 . . . . 0.0 110.343 179.786 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.583 HD11 ' H62' ' C' ' 124' ' ' ' DA' . 41.6 mt -76.33 -60.45 2.33 Favored 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.471 -1.017 . . . . 0.0 109.617 -179.717 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.833 ' HA ' HD22 ' A' ' 37' ' ' LEU . 51.3 t80 -48.05 -38.88 18.39 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.303 -0.873 . . . . 0.0 109.289 179.593 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.495 ' CD2' ' O ' ' A' ' 40' ' ' VAL . 58.3 t80 -54.24 -53.9 47.37 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.439 -0.788 . . . . 0.0 109.602 179.169 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -63.04 -38.11 89.89 Favored 'General case' 0 N--CA 1.502 2.143 0 O-C-N 121.113 -0.992 . . . . 0.0 110.459 -179.742 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.833 HD22 ' HA ' ' A' ' 34' ' ' TYR . 4.1 mp -42.77 -57.5 2.74 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.437 -0.79 . . . . 0.0 110.353 -179.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.685 ' HB2' HG22 ' A' ' 40' ' ' VAL . 33.0 m-70 -118.3 13.69 13.7 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 121.286 -0.884 . . . . 0.0 109.705 179.373 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.47 ' N ' ' O ' ' A' ' 35' ' ' TYR . 17.6 tt0 45.76 47.33 11.9 Favored 'General case' 0 N--CA 1.502 2.128 0 CA-C-O 121.842 0.83 . . . . 0.0 109.788 -179.107 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.685 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.1 m -130.86 -170.82 0.72 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.257 0 O-C-N 121.545 -0.722 . . . . 0.0 109.71 -179.759 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -61.69 -173.62 0.04 OUTLIER 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.267 -0.896 . . . . 0.0 110.177 -179.968 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.525 ' HD3' ' HB3' ' A' ' 31' ' ' CYS . 29.7 mtt180 -130.0 93.55 33.5 Favored Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 121.1 -1.0 . . . . 0.0 109.976 -179.207 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.561 ' HD2' ' CE1' ' A' ' 34' ' ' TYR . 5.0 Cg_exo -58.75 126.63 21.78 Favored 'Trans proline' 0 C--N 1.318 -1.061 0 C-N-CA 122.559 2.173 . . . . 0.0 110.866 179.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.603 ' HB3' ' HA ' ' A' ' 10' ' ' CYS . 0.8 OUTLIER -96.88 17.32 17.03 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.45 -0.781 . . . . 0.0 110.586 -179.94 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 13.2 p -74.16 -4.57 36.6 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.996 -1.065 . . . . 0.0 110.198 179.187 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.542 ' HE1' " O3'" ' C' ' 122' ' ' ' DT' . 1.0 OUTLIER -103.91 -0.66 28.76 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.082 -1.011 . . . . 0.0 110.626 179.819 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 9.4 mmm180 -51.13 141.36 14.44 Favored 'General case' 0 N--CA 1.502 2.156 0 O-C-N 120.628 -1.295 . . . . 0.0 110.215 -179.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.2 mmmm -119.38 -163.99 1.02 Allowed 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.514 -0.741 . . . . 0.0 109.52 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 1.6 m-20 -79.51 -89.35 0.06 Allowed 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.209 -0.932 . . . . 0.0 110.175 -179.852 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -96.11 165.91 24.34 Favored Glycine 0 N--CA 1.499 2.864 0 N-CA-C 109.869 -1.293 . . . . 0.0 109.869 179.901 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.405 HD11 ' C ' ' A' ' 15' ' ' THR . 5.4 mt -54.3 129.06 15.01 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.246 -1.15 . . . . 0.0 109.767 179.816 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.2 mt-30 -70.33 141.91 52.25 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.297 -0.877 . . . . 0.0 109.275 179.442 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -153.72 158.13 40.54 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.946 -1.097 . . . . 0.0 110.159 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.471 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 1.1 mtm-85 -153.16 -158.47 0.89 Allowed 'General case' 0 N--CA 1.495 1.813 0 N-CA-C 109.422 -0.585 . . . . 0.0 109.422 179.692 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 51.0 t-20 -58.37 106.11 0.35 Allowed 'General case' 0 N--CA 1.495 1.8 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.633 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.04 139.29 4.54 Favored 'General case' 0 N--CA 1.497 1.91 0 CA-C-O 121.521 0.677 . . . . 0.0 110.94 -178.475 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -55.65 140.78 40.19 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.581 -0.699 . . . . 0.0 109.949 179.939 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -61.68 163.99 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.529 -0.732 . . . . 0.0 110.228 -179.735 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -68.53 110.45 4.2 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.084 -1.01 . . . . 0.0 109.601 -179.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.9 t . . . . . 0 N--CA 1.497 1.875 0 O-C-N 121.123 -0.986 . . . . 0.0 109.498 179.734 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.493 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.441 1.618 0 C5'-C4'-C3' 109.816 -3.256 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.502 H2'' " O5'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.524 1.598 1 O4'-C1'-N19 111.371 4.464 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.618 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.804 0 O4'-C1'-N19 110.805 3.756 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.618 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.782 0 O4'-C1'-N19 110.885 3.856 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.454 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.705 0 O4'-C1'-N19 110.719 3.649 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.798 0 O4'-C1'-N19 110.616 3.52 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.48 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.614 0 O4'-C1'-N19 110.99 3.987 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.48 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.78 0 C3'-C2'-C1' 107.055 3.111 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.646 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.777 1 O4'-C1'-N19 111.005 4.006 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.646 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.649 1 O4'-C1'-N19 111.929 5.162 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.635 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.278 0 O4'-C1'-N19 110.919 3.898 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.521 ' H71' ' HB3' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.524 1.674 0 C3'-C2'-C1' 107.106 3.147 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.735 ' H62' HD11 ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.187 0 O4'-C1'-N19 110.314 3.142 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.591 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.626 1 O4'-C1'-N19 112.209 5.511 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.591 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.595 0 O4'-C1'-N19 110.479 3.348 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.421 ' C6 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.118 0 O4'-C1'-N19 110.897 3.871 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 3.3 ptpp? . . . . . 0 N--CA 1.498 1.974 0 N-CA-C 109.702 -0.481 . . . . 0.0 109.702 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 2.7 mpt_? -100.66 86.36 3.1 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.498 -0.751 . . . . 0.0 109.392 179.696 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.34 141.02 57.26 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.314 -0.866 . . . . 0.0 109.42 179.82 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.474 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 94.35 -37.13 3.49 Favored Glycine 0 N--CA 1.497 2.759 0 N-CA-C 109.404 -1.478 . . . . 0.0 109.404 -179.315 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 24.4 m -60.61 96.37 0.04 OUTLIER 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.273 -1.134 . . . . 0.0 109.231 179.265 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.474 HG13 ' O ' ' A' ' 4' ' ' GLY . 20.8 m -96.94 138.72 21.19 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.341 -0.985 . . . . 0.0 108.341 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.532 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 22.1 t -59.88 122.67 14.82 Favored 'General case' 0 N--CA 1.492 1.63 0 O-C-N 121.425 -0.797 . . . . 0.0 110.835 -178.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.7 m -65.45 -16.04 63.24 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.193 -0.942 . . . . 0.0 109.965 178.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.519 ' ND2' HG11 ' A' ' 27' ' ' VAL . 34.0 m-20 -104.11 -19.17 14.26 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.031 -1.043 . . . . 0.0 111.209 -179.443 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.517 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 9.0 p -154.0 26.28 0.48 Allowed 'General case' 0 N--CA 1.502 2.154 0 O-C-N 120.63 -1.294 . . . . 0.0 111.151 179.82 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.658 ' OE1' HD13 ' A' ' 44' ' ' LEU . 1.0 OUTLIER 31.15 37.11 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.642 0 N-CA-C 113.535 0.939 . . . . 0.0 113.535 178.901 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.591 HG23 HG22 ' A' ' 15' ' ' THR . 5.5 t -90.39 131.85 35.93 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.565 -1.335 . . . . 0.0 108.794 178.586 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 91.6 p -89.39 -26.37 21.06 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.447 -0.783 . . . . 0.0 109.426 -179.959 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.5 p -99.51 113.3 25.6 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.485 -0.76 . . . . 0.0 109.124 179.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.591 HG22 HG23 ' A' ' 12' ' ' THR . 6.8 p -132.96 164.29 27.29 Favored 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.31 -0.869 . . . . 0.0 110.197 -179.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.58 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 11.5 p -74.85 -45.95 39.67 Favored 'General case' 0 N--CA 1.488 1.461 0 N-CA-C 107.924 -1.139 . . . . 0.0 107.924 178.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.427 ' CD1' ' O6 ' ' B' ' 107' ' ' ' DG' . 12.8 mt -147.57 116.49 6.8 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.709 -0.849 . . . . 0.0 108.709 178.691 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . . . . . . . . . 18.6 m95 -64.96 98.92 0.31 Allowed 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.475 -0.765 . . . . 0.0 110.112 -179.114 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -79.88 75.38 6.59 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.514 -0.741 . . . . 0.0 109.62 -179.895 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.9 tpp180 -64.2 95.59 0.13 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.277 -0.889 . . . . 0.0 108.976 179.65 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.7 OUTLIER -56.14 147.13 47.38 Favored Pre-proline 0 N--CA 1.499 2.017 0 O-C-N 121.437 -0.789 . . . . 0.0 110.133 -179.184 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.7 Cg_exo -56.16 -33.66 91.01 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.383 2.055 . . . . 0.0 110.696 -179.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 4.8 mtm -60.32 -23.15 63.98 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.214 -0.929 . . . . 0.0 109.537 179.192 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 108.89 45.64 1.01 Allowed Glycine 0 N--CA 1.497 2.733 0 N-CA-C 109.677 -1.369 . . . . 0.0 109.677 179.903 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 15.4 m-20 -134.84 104.26 10.77 Favored Pre-proline 0 N--CA 1.493 1.688 0 O-C-N 121.468 -1.019 . . . . 0.0 110.277 -179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.508 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.6 Cg_endo -66.13 87.59 0.25 Allowed 'Trans proline' 0 C--N 1.313 -1.326 0 C-N-CA 122.317 2.011 . . . . 0.0 109.639 178.918 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.532 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -109.53 124.48 66.26 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.85 0 O-C-N 121.111 -0.993 . . . . 0.0 110.371 -179.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.553 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.5 p -46.25 134.28 8.82 Favored 'General case' 0 N--CA 1.485 1.324 0 O-C-N 121.744 -0.597 . . . . 0.0 109.591 179.279 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.419 ' C ' ' O ' ' A' ' 28' ' ' CYS . 2.2 t-20 -34.74 -46.29 0.29 Allowed 'General case' 0 N--CA 1.506 2.357 0 O-C-N 121.747 -0.595 . . . . 0.0 111.46 -179.006 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.653 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -47.66 -51.81 20.33 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.509 -0.745 . . . . 0.0 111.27 -179.831 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.533 ' HA ' ' HD3' ' A' ' 42' ' ' ARG . 52.0 m -62.35 -40.86 97.79 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.148 -0.97 . . . . 0.0 109.885 -179.538 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -62.11 -35.69 91.86 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 110.329 -1.108 . . . . 0.0 110.329 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.735 HD11 ' H62' ' C' ' 124' ' ' ' DA' . 83.6 mt -73.69 -62.19 1.58 Allowed 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.294 -1.121 . . . . 0.0 109.717 -179.863 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.475 ' CE1' ' HB3' ' A' ' 42' ' ' ARG . 32.1 t80 -51.71 -38.36 54.86 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.441 -0.948 . . . . 0.0 108.441 178.965 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.547 ' O ' ' N ' ' A' ' 39' ' ' GLN . 32.1 t80 -64.28 -43.72 93.93 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.465 -0.772 . . . . 0.0 110.118 179.033 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.54 ' HD2' ' CD1' ' A' ' 37' ' ' LEU . 0.2 OUTLIER -60.44 -21.92 62.84 Favored 'General case' 0 N--CA 1.5 2.033 0 O-C-N 119.988 -1.695 . . . . 0.0 110.059 179.397 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.54 ' CD1' ' HD2' ' A' ' 36' ' ' LYS . 0.5 OUTLIER -84.74 -59.18 2.43 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.074 -1.016 . . . . 0.0 110.087 -179.593 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 12.1 m-70 -93.03 -28.48 16.36 Favored 'General case' 0 N--CA 1.503 2.211 0 O-C-N 121.21 -0.931 . . . . 0.0 109.695 -179.894 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.547 ' N ' ' O ' ' A' ' 35' ' ' TYR . 4.7 tt0 61.86 47.8 5.8 Favored 'General case' 0 N--CA 1.498 1.967 0 CA-C-O 122.262 1.029 . . . . 0.0 109.999 179.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.4 m -141.17 168.56 15.81 Favored 'Isoleucine or valine' 0 C--N 1.306 -1.306 0 N-CA-C 108.37 -0.974 . . . . 0.0 108.37 179.051 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 6.3 p30 -71.4 125.75 27.82 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.788 -1.195 . . . . 0.0 108.429 179.364 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.533 ' HD3' ' HA ' ' A' ' 31' ' ' CYS . 1.8 ptm180 -95.5 146.99 32.3 Favored Pre-proline 0 N--CA 1.493 1.706 0 O-C-N 121.229 -0.919 . . . . 0.0 109.496 -178.873 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.572 ' HB2' HG22 ' A' ' 45' ' ' THR . 1.8 Cg_endo -62.71 133.53 42.66 Favored 'Trans proline' 0 C--N 1.313 -1.322 0 C-N-CA 122.196 1.93 . . . . 0.0 110.565 -179.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.658 HD13 ' OE1' ' A' ' 11' ' ' GLN . 0.5 OUTLIER -76.51 -6.93 53.95 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.468 -0.77 . . . . 0.0 110.375 179.654 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.572 HG22 ' HB2' ' A' ' 43' ' ' PRO . 14.6 t -60.66 -28.09 68.31 Favored 'General case' 0 N--CA 1.503 2.18 0 O-C-N 121.12 -0.987 . . . . 0.0 110.798 179.829 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.3 OUTLIER -77.54 -21.44 52.6 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 120.916 -1.115 . . . . 0.0 110.178 179.599 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.57 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -76.08 149.72 37.41 Favored 'General case' 0 N--CA 1.499 1.975 0 O-C-N 121.022 -1.049 . . . . 0.0 108.997 179.417 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.407 ' N ' ' HG2' ' A' ' 47' ' ' ARG . 34.8 mttm -124.84 -166.07 1.48 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.016 -1.052 . . . . 0.0 110.013 -179.517 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 4.6 p-10 -91.69 -45.56 8.38 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.072 -1.017 . . . . 0.0 109.9 -179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -95.08 135.46 12.42 Favored Glycine 0 N--CA 1.499 2.873 0 N-CA-C 109.486 -1.446 . . . . 0.0 109.486 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . . . . . . . . . 4.8 mt -50.62 120.97 1.32 Allowed 'Isoleucine or valine' 0 N--CA 1.497 1.89 0 O-C-N 121.164 -1.197 . . . . 0.0 109.802 -179.895 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 9.4 mt-30 -63.39 151.14 41.78 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.632 -0.667 . . . . 0.0 109.895 179.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.451 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -156.32 154.98 31.46 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 120.977 -1.077 . . . . 0.0 109.366 178.853 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.451 ' HG2' ' O ' ' A' ' 53' ' ' THR . 5.9 mtp180 -150.89 -161.87 1.43 Allowed 'General case' 0 N--CA 1.495 1.805 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 -179.512 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 29.5 t-20 -53.25 130.73 35.67 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.928 -1.107 . . . . 0.0 109.136 179.454 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.451 ' HD3' ' OP1' ' C' ' 126' ' ' ' DC' . 20.3 mtt180 -76.14 160.43 29.75 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.418 -0.801 . . . . 0.0 110.125 -179.053 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -79.5 124.23 28.29 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.358 -0.839 . . . . 0.0 109.722 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 73.1 t -61.91 144.48 14.04 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.48 -0.762 . . . . 0.0 109.467 179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.2 t -64.68 100.16 0.37 Allowed 'General case' 0 N--CA 1.492 1.635 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 179.33 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 47.9 t . . . . . 0 N--CA 1.496 1.862 0 O-C-N 121.335 -0.853 . . . . 0.0 109.684 -179.388 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.512 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.444 1.813 0 O4'-C1'-N19 110.722 3.653 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.512 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.775 1 O4'-C1'-N19 111.645 4.807 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.657 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.228 1 O4'-C1'-N19 111.234 4.292 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.657 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.13 1 O4'-C1'-N19 111.12 4.15 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.456 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.141 0 O4'-C1'-N19 110.664 3.581 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.416 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.018 1 O4'-C1'-N19 111.042 4.052 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.416 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.001 1 O4'-C1'-N19 111.38 4.475 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.425 " H5'" ' CZ ' ' A' ' 54' ' ' ARG . . . . . . . . 0 P--O5' 1.612 1.865 0 C3'-C2'-C1' 107.182 3.201 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.684 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.786 1 O4'-C1'-N19 111.231 4.288 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.684 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.381 1 O4'-C1'-N19 111.861 5.076 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.658 ' OP2' HD23 ' A' ' 37' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.095 1 O4'-C1'-N19 111.169 4.211 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.468 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.756 0 O4'-C1'-N19 110.371 3.214 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.693 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.313 0 O4'-C1'-N19 110.705 3.632 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.86 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.527 1.942 1 O4'-C1'-N19 112.169 5.462 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.631 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.791 1 O4'-C1'-N19 111.129 4.161 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.429 ' H71' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 1.956 1 O4'-C1'-N19 111.109 4.137 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.494 1.771 0 N-CA-C 109.117 -0.697 . . . . 0.0 109.117 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.3 mpp_? -87.21 7.38 28.64 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.208 -0.933 . . . . 0.0 110.353 179.975 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -63.33 142.97 58.19 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.068 -1.02 . . . . 0.0 109.284 179.343 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.51 -30.66 9.2 Favored Glycine 0 N--CA 1.496 2.653 0 N-CA-C 109.211 -1.555 . . . . 0.0 109.211 -178.945 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.612 HG23 ' HB2' ' A' ' 26' ' ' PRO . 15.5 m -70.77 89.09 0.74 Allowed 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.211 -1.17 . . . . 0.0 109.627 179.61 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.446 HG23 ' O ' ' A' ' 6' ' ' VAL . 20.3 m -97.06 124.11 49.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.74 0 N-CA-C 108.024 -1.102 . . . . 0.0 108.024 179.148 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 7.9 t -43.66 113.99 0.58 Allowed 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.395 -0.816 . . . . 0.0 111.269 -178.523 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 69.3 m -59.62 -10.65 3.75 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.106 -0.996 . . . . 0.0 111.178 179.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 2.1 m-80 -110.4 -28.66 8.46 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.812 -1.18 . . . . 0.0 110.956 -179.755 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.568 ' O ' ' HD3' ' A' ' 47' ' ' ARG . 2.4 p -138.32 21.97 2.77 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 120.877 -1.139 . . . . 0.0 110.159 179.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.506 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER 30.53 37.57 0.0 OUTLIER 'General case' 0 N--CA 1.508 2.473 0 N-CA-C 112.857 0.688 . . . . 0.0 112.857 179.272 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.453 HG23 ' O ' ' A' ' 12' ' ' THR . 14.9 t -90.83 126.22 35.96 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 120.783 -1.198 . . . . 0.0 109.072 178.777 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.7 p -89.66 -15.01 33.6 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.51 -0.744 . . . . 0.0 109.699 179.776 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -102.7 99.77 9.76 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.287 -0.883 . . . . 0.0 109.386 -179.999 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.463 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 6.5 p -122.6 163.05 20.71 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.175 -0.953 . . . . 0.0 110.292 -179.654 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.86 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 81.9 p -94.11 -32.17 13.87 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 109.014 -0.736 . . . . 0.0 109.014 179.276 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.658 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 67.5 mt -142.75 87.23 1.98 Allowed 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.317 -0.864 . . . . 0.0 109.263 179.119 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.463 ' CZ2' HG23 ' A' ' 15' ' ' THR . 13.1 m95 -54.54 109.27 0.48 Allowed 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.077 -1.014 . . . . 0.0 110.162 -179.712 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.516 ' O ' ' HG3' ' A' ' 19' ' ' ARG . 0.0 OUTLIER -101.66 130.23 47.98 Favored 'General case' 0 N--CA 1.488 1.449 0 O-C-N 121.348 -0.845 . . . . 0.0 109.018 179.658 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 8.9 mmt180 -97.27 109.62 22.34 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.248 -0.908 . . . . 0.0 108.875 -179.871 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -64.74 146.5 98.49 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.177 -0.952 . . . . 0.0 109.392 -179.505 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_exo -58.1 -21.09 49.17 Favored 'Trans proline' 0 C--N 1.319 -1.015 0 C-N-CA 122.2 1.934 . . . . 0.0 110.613 179.935 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 10.8 mtt -81.54 -0.96 44.43 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.317 -0.864 . . . . 0.0 109.788 179.287 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 89.89 35.43 7.73 Favored Glycine 0 N--CA 1.497 2.711 0 N-CA-C 109.552 -1.419 . . . . 0.0 109.552 -179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.6 m-20 -124.22 105.24 31.47 Favored Pre-proline 0 N--CA 1.494 1.754 0 O-C-N 121.386 -1.067 . . . . 0.0 110.524 -179.274 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.612 ' HB2' HG23 ' A' ' 5' ' ' THR . 1.5 Cg_endo -66.63 93.27 0.31 Allowed 'Trans proline' 0 C--N 1.314 -1.27 0 C-N-CA 122.235 1.957 . . . . 0.0 109.579 178.611 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.534 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -109.75 124.47 66.49 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 O-C-N 121.107 -0.996 . . . . 0.0 110.561 -179.448 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.426 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 7.4 p -45.97 131.43 9.72 Favored 'General case' 0 N--CA 1.488 1.475 0 O-C-N 121.753 -0.592 . . . . 0.0 110.398 179.657 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.658 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 7.2 t-20 -36.63 -45.56 0.53 Allowed 'General case' 0 N--CA 1.511 2.587 0 O-C-N 121.708 -0.62 . . . . 0.0 111.934 -178.869 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.24 -49.05 34.77 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.563 -0.711 . . . . 0.0 109.93 -179.79 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.618 ' O ' ' HD2' ' A' ' 42' ' ' ARG . 8.9 m -59.65 -46.35 89.27 Favored 'General case' 0 N--CA 1.496 1.875 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 178.71 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -55.03 -54.6 32.83 Favored Glycine 0 N--CA 1.495 2.593 0 N-CA-C 109.8 -1.32 . . . . 0.0 109.8 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.525 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 96.0 mt -59.23 -57.62 12.24 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.644 -0.915 . . . . 0.0 109.594 179.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.417 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 30.6 t80 -43.8 -36.4 2.29 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.339 -0.851 . . . . 0.0 109.59 179.465 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.49 ' O ' ' N ' ' A' ' 39' ' ' GLN . 38.7 t80 -58.82 -52.81 64.12 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.333 -0.854 . . . . 0.0 109.722 178.904 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.525 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -65.65 -26.97 68.05 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 120.964 -1.085 . . . . 0.0 110.483 -179.945 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.658 HD23 ' OP2' ' C' ' 122' ' ' ' DT' . 9.8 mp -53.53 -57.69 9.82 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.215 -0.928 . . . . 0.0 109.285 179.483 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.501 ' CB ' HG22 ' A' ' 40' ' ' VAL . 76.8 m-70 -113.79 11.65 18.07 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 121.18 -0.95 . . . . 0.0 109.771 178.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.49 ' N ' ' O ' ' A' ' 35' ' ' TYR . 4.9 tm0? 51.92 30.93 7.77 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.362 -0.836 . . . . 0.0 110.018 -179.281 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.501 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.2 m -131.38 -171.29 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.335 0 O-C-N 121.35 -0.844 . . . . 0.0 109.516 179.66 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.5 p-10 -66.72 -173.2 0.21 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.249 -0.907 . . . . 0.0 110.105 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.618 ' HD2' ' O ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -142.78 116.62 6.3 Favored Pre-proline 0 N--CA 1.495 1.787 0 O-C-N 121.102 -0.999 . . . . 0.0 109.702 179.914 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 2.1 Cg_endo -63.37 147.79 93.25 Favored 'Trans proline' 0 C--N 1.313 -1.323 0 C-N-CA 122.069 1.846 . . . . 0.0 110.302 179.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . . . . . . . . . 0.8 OUTLIER -91.37 16.71 9.61 Favored 'General case' 0 N--CA 1.5 2.034 0 O-C-N 121.199 -0.938 . . . . 0.0 110.392 179.632 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -76.06 -12.95 60.21 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.054 -1.029 . . . . 0.0 109.858 179.125 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.424 ' O ' ' HG3' ' A' ' 46' ' ' MET . 0.0 OUTLIER -89.36 -5.23 57.65 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.034 -1.041 . . . . 0.0 110.664 179.632 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.568 ' HD3' ' O ' ' A' ' 10' ' ' CYS . 65.6 mtm180 -57.27 165.25 1.48 Allowed 'General case' 0 N--CA 1.504 2.236 0 O-C-N 120.65 -1.281 . . . . 0.0 110.571 -179.877 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -145.22 145.62 31.39 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.421 -0.799 . . . . 0.0 109.926 179.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -47.6 -36.57 10.96 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 121.636 -0.665 . . . . 0.0 110.01 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -134.0 146.84 18.76 Favored Glycine 0 N--CA 1.494 2.515 0 N-CA-C 108.48 -1.848 . . . . 0.0 108.48 179.042 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.555 HG21 HG22 ' A' ' 16' ' ' THR . 5.3 mt -46.73 114.79 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 121.474 -1.015 . . . . 0.0 110.016 -179.747 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 3.5 mt-30 -51.55 142.32 14.37 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.579 -0.701 . . . . 0.0 109.497 179.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.36 159.09 39.66 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.96 -1.087 . . . . 0.0 110.054 179.709 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.425 ' CZ ' " H5'" ' B' ' 113' ' ' ' DC' . 0.1 OUTLIER -150.57 -157.65 0.83 Allowed 'General case' 0 N--CA 1.496 1.848 0 N-CA-C 108.67 -0.863 . . . . 0.0 108.67 -179.703 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.3 OUTLIER -62.74 97.18 0.1 Allowed 'General case' 0 N--CA 1.493 1.717 0 O-C-N 120.884 -1.135 . . . . 0.0 108.726 179.048 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.439 ' O ' ' HG3' ' A' ' 56' ' ' ARG . 0.2 OUTLIER -45.06 143.59 1.51 Allowed 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.678 -0.639 . . . . 0.0 110.473 -179.114 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.451 ' HE2' " O4'" ' B' ' 110' ' ' ' DA' . 0.0 OUTLIER -54.92 119.53 5.54 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.397 -0.814 . . . . 0.0 110.086 -179.697 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.4 p -67.91 139.4 20.87 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.536 -0.728 . . . . 0.0 109.545 179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 58.6 m -66.76 109.49 2.9 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.314 -0.866 . . . . 0.0 110.49 -179.222 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 4.2 t . . . . . 0 N--CA 1.495 1.798 0 O-C-N 121.388 -0.82 . . . . 0.0 109.594 179.554 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.574 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.919 0 O4'-C1'-N19 110.61 3.512 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.574 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.081 1 O4'-C1'-N19 111.685 4.856 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.551 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.511 1 O4'-C1'-N19 111.307 4.383 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.551 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.552 1 O4'-C1'-N19 111.288 4.36 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.494 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.612 1.896 0 O4'-C1'-N19 110.6 3.5 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.442 1.718 0 O4'-C1'-N19 110.791 3.738 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.524 1.643 1 O4'-C1'-N19 111.537 4.671 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.861 0 O4'-C1'-N19 110.531 3.414 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.675 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.832 0 O4'-C1'-N19 110.977 3.971 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.675 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.594 1 O4'-C1'-N19 111.83 5.037 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.551 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.089 0 O4'-C1'-N19 110.999 3.999 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.477 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.722 0 O4'-C1'-N19 110.531 3.414 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.488 ' N6 ' ' N6 ' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.568 0 O4'-C1'-N19 110.656 3.57 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.629 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.321 1 O4'-C1'-N19 112.465 5.831 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.556 " H2'" ' C5 ' ' C' ' 127' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.726 0 O4'-C1'-N19 110.757 3.697 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.556 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 P--O5' 1.616 2.33 1 O4'-C1'-N19 111.029 4.036 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 9.5 tptt . . . . . 0 N--CA 1.498 1.961 0 N-CA-C 110.301 -0.259 . . . . 0.0 110.301 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.27 -41.68 76.22 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.121 -0.987 . . . . 0.0 109.352 179.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.99 152.61 19.38 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.771 -0.581 . . . . 0.0 109.589 179.185 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 93.32 -19.67 50.99 Favored Glycine 0 N--CA 1.497 2.727 0 N-CA-C 109.736 -1.345 . . . . 0.0 109.736 -179.191 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.598 HG23 ' HB2' ' A' ' 26' ' ' PRO . 54.5 m -69.19 87.84 0.42 Allowed 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.049 -1.266 . . . . 0.0 109.249 179.532 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.544 HG23 ' O ' ' A' ' 6' ' ' VAL . 34.6 m -78.8 110.12 14.2 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.727 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 179.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.5 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 41.0 t -47.44 109.44 0.22 Allowed 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.262 -0.899 . . . . 0.0 110.391 -178.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 24.7 m -59.39 -12.49 6.03 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.326 -0.859 . . . . 0.0 111.628 -179.476 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.7 ' OD1' HG11 ' A' ' 27' ' ' VAL . 2.1 m120 -95.61 -28.84 14.64 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.612 -1.305 . . . . 0.0 111.059 -179.813 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.644 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 15.0 p -142.37 17.22 2.05 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.863 -1.148 . . . . 0.0 111.494 -179.848 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 4.3 mp0 53.43 18.65 1.4 Allowed 'General case' 0 N--CA 1.502 2.162 0 O-C-N 121.2 -0.937 . . . . 0.0 112.052 179.023 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.575 HG22 ' SG ' ' A' ' 10' ' ' CYS . 14.5 t -84.15 128.72 34.74 Favored 'General case' 0 N--CA 1.497 1.876 0 O-C-N 120.401 -1.437 . . . . 0.0 109.786 179.46 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 16.2 p -89.72 -28.46 19.39 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.444 -0.785 . . . . 0.0 109.533 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.436 ' HB ' HG13 ' A' ' 51' ' ' ILE . 27.9 p -93.32 127.44 38.92 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.647 ' O ' HD11 ' A' ' 51' ' ' ILE . 4.8 p -146.44 145.49 30.25 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.034 -1.041 . . . . 0.0 110.097 179.954 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.629 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 25.1 p -68.0 -32.06 72.18 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 179.104 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 13.5 mt -149.03 122.6 9.15 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.332 -0.855 . . . . 0.0 109.57 179.632 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.565 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.8 m95 -80.89 109.13 15.17 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.302 -0.874 . . . . 0.0 110.255 -179.535 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -94.09 78.69 4.05 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.39 -0.819 . . . . 0.0 108.904 179.452 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -60.8 122.9 15.99 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.216 -0.927 . . . . 0.0 109.872 -179.554 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -85.7 143.26 37.95 Favored Pre-proline 0 N--CA 1.495 1.803 0 O-C-N 121.592 -0.693 . . . . 0.0 109.518 179.766 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -56.86 -38.82 94.98 Favored 'Trans proline' 0 C--N 1.32 -0.939 0 C-N-CA 122.496 2.13 . . . . 0.0 110.742 -179.981 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.36 -23.73 50.83 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.405 -0.809 . . . . 0.0 109.586 179.139 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 109.78 39.06 1.63 Allowed Glycine 0 N--CA 1.496 2.658 0 N-CA-C 109.576 -1.41 . . . . 0.0 109.576 179.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 9.3 m-20 -133.18 97.15 16.73 Favored Pre-proline 0 N--CA 1.494 1.752 0 O-C-N 121.397 -1.061 . . . . 0.0 110.177 -179.609 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.598 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.9 Cg_endo -63.98 112.68 1.91 Allowed 'Trans proline' 0 C--N 1.312 -1.387 0 C-N-CA 122.091 1.861 . . . . 0.0 109.952 179.029 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.7 HG11 ' OD1' ' A' ' 9' ' ' ASN . 3.3 m -122.62 129.1 75.45 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 O-C-N 121.074 -1.017 . . . . 0.0 110.5 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.522 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 8.2 p -52.68 139.2 26.84 Favored 'General case' 0 N--CA 1.485 1.288 0 CA-C-O 121.441 0.638 . . . . 0.0 110.559 -179.859 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 19.7 t-20 -40.35 -47.78 2.58 Favored 'General case' 0 N--CA 1.506 2.356 0 O-C-N 121.88 -0.512 . . . . 0.0 112.071 -178.805 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.43 -41.68 52.91 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.195 -0.941 . . . . 0.0 110.355 -179.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.409 ' HB3' ' HD2' ' A' ' 42' ' ' ARG . 9.6 m -66.77 -36.81 83.29 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 121.156 -0.965 . . . . 0.0 108.526 178.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -66.81 -48.79 59.24 Favored Glycine 0 N--CA 1.491 2.317 0 N-CA-C 109.759 -1.336 . . . . 0.0 109.759 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.436 ' O ' HD13 ' A' ' 37' ' ' LEU . 93.8 mt -61.04 -59.44 5.36 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.583 -0.951 . . . . 0.0 109.619 179.953 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.487 ' CD1' ' HB3' ' A' ' 42' ' ' ARG . 18.4 t80 -47.97 -40.35 22.07 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.564 -0.71 . . . . 0.0 109.515 179.582 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.446 ' HB2' ' NH1' ' A' ' 42' ' ' ARG . 41.4 t80 -58.33 -49.9 75.53 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.313 -0.867 . . . . 0.0 109.62 179.209 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 5.5 tttt -61.14 -34.66 75.36 Favored 'General case' 0 N--CA 1.501 2.119 0 O-C-N 120.979 -1.076 . . . . 0.0 109.945 179.756 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.436 HD13 ' O ' ' A' ' 33' ' ' LEU . 9.1 mp -53.62 -63.27 1.2 Allowed 'General case' 0 N--CA 1.503 2.216 0 O-C-N 121.657 -0.652 . . . . 0.0 110.682 -179.41 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.534 ' O ' ' HG2' ' A' ' 39' ' ' GLN . 83.1 m-70 -105.93 12.58 30.44 Favored 'General case' 0 N--CA 1.498 1.968 0 O-C-N 121.121 -0.987 . . . . 0.0 110.39 -179.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.534 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.8 OUTLIER 47.42 28.35 1.1 Allowed 'General case' 0 N--CA 1.508 2.432 0 CA-C-O 121.614 0.721 . . . . 0.0 110.895 -179.327 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.497 HG22 ' CB ' ' A' ' 38' ' ' HIS . 8.2 m -130.96 -170.45 0.7 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.287 0 O-C-N 121.203 -0.936 . . . . 0.0 109.873 179.965 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.1 p30 -62.47 -177.27 0.13 Allowed 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.497 -0.752 . . . . 0.0 109.853 179.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.487 ' HB3' ' CD1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -146.28 111.17 4.33 Favored Pre-proline 0 N--CA 1.495 1.789 0 O-C-N 120.902 -1.124 . . . . 0.0 110.179 -179.524 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.0 Cg_exo -60.15 134.04 53.56 Favored 'Trans proline' 0 C--N 1.316 -1.157 0 C-N-CA 122.115 1.877 . . . . 0.0 110.298 179.558 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.644 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 1.2 pp -88.8 9.93 22.83 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.303 -0.873 . . . . 0.0 110.835 179.976 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 43.7 p -70.36 -9.93 57.6 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.064 -1.022 . . . . 0.0 110.569 179.745 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.5 ttt -95.77 -22.05 17.75 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.94 -1.1 . . . . 0.0 110.531 -179.814 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.467 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -67.27 152.02 46.47 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.829 -1.169 . . . . 0.0 110.055 -179.895 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.413 ' HB2' ' OE1' ' A' ' 52' ' ' GLN . 0.1 OUTLIER -106.94 -160.52 0.74 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.379 -0.826 . . . . 0.0 109.716 179.836 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 24.3 t70 -47.67 -73.2 0.04 OUTLIER 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.264 -0.897 . . . . 0.0 110.698 -179.268 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -136.48 -158.52 8.09 Favored Glycine 0 N--CA 1.498 2.778 0 N-CA-C 109.973 -1.251 . . . . 0.0 109.973 179.915 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.647 HD11 ' O ' ' A' ' 15' ' ' THR . 9.3 mt -50.91 111.15 0.18 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 O-C-N 121.223 -1.163 . . . . 0.0 110.033 -179.784 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.413 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -78.16 156.45 29.87 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.423 -0.798 . . . . 0.0 109.213 179.612 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -154.99 163.05 40.85 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.137 -0.977 . . . . 0.0 109.718 179.56 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.85 -168.77 3.2 Favored 'General case' 0 N--CA 1.497 1.921 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 -179.823 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -66.04 124.88 23.75 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 120.944 -1.097 . . . . 0.0 108.99 179.261 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.405 ' HD3' ' OP1' ' C' ' 126' ' ' ' DC' . 29.5 mtt180 -53.22 136.84 35.72 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.438 -0.789 . . . . 0.0 110.07 -179.084 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.43 151.02 41.28 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.538 -0.727 . . . . 0.0 109.799 179.673 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.3 p -52.69 138.91 10.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.916 0 O-C-N 121.336 -0.853 . . . . 0.0 109.88 -179.773 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.65 111.06 1.68 Allowed 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.3 -0.875 . . . . 0.0 109.475 -179.836 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 20.6 t . . . . . 0 N--CA 1.498 1.947 0 O-C-N 121.649 -0.657 . . . . 0.0 110.205 -179.491 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.504 ' C6 ' ' C6 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.524 1.663 0 O4'-C1'-N19 110.526 3.407 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.845 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.442 1.664 0 O4'-C1'-N19 110.784 3.73 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.579 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.914 0 O4'-C1'-N19 110.904 3.879 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.579 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.694 0 O4'-C1'-N19 110.659 3.574 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.43 H2'' ' C8 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.821 0 O4'-C1'-N19 110.859 3.824 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.444 " H4'" ' HG2' ' A' ' 57' ' ' LYS . . . . . . . . 0 O4'--C1' 1.443 1.805 0 O4'-C1'-N19 110.675 3.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.484 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 O4'--C1' 1.442 1.694 1 O4'-C1'-N19 111.297 4.372 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.484 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.819 0 C3'-C2'-C1' 107.194 3.21 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.652 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.796 0 O4'-C1'-N19 110.712 3.64 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.652 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.669 1 O4'-C1'-N19 111.672 4.84 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.621 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.213 1 O4'-C1'-N19 111.026 4.033 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.487 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 P--O5' 1.61 1.707 0 C3'-C2'-C1' 107.088 3.134 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.66 ' H62' ' CD1' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.531 2.486 0 O4'-C1'-N19 110.541 3.427 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.666 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.808 1 O4'-C1'-N19 112.641 6.051 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.469 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.534 2.838 0 O4'-C1'-N19 110.84 3.8 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.463 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.2 0 O4'-C1'-N19 110.874 3.843 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER . . . . . 0 N--CA 1.498 1.959 0 CA-C-O 120.437 0.16 . . . . 0.0 111.333 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -74.3 -27.03 60.53 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.73 -1.231 . . . . 0.0 109.839 179.575 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -55.9 140.73 41.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.28 -0.887 . . . . 0.0 109.407 179.465 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.31 -22.57 32.5 Favored Glycine 0 N--CA 1.498 2.806 0 N-CA-C 109.855 -1.298 . . . . 0.0 109.855 -179.315 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.402 ' CG2' ' HB2' ' A' ' 26' ' ' PRO . 26.4 m -66.9 99.87 0.67 Allowed 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.121 -1.223 . . . . 0.0 109.717 179.997 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 6.8 m -97.82 104.32 15.77 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.619 0 N-CA-C 107.93 -1.137 . . . . 0.0 107.93 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.577 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 42.3 t -40.72 106.88 0.06 Allowed 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.719 -0.613 . . . . 0.0 110.549 -178.723 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 34.4 m -57.31 -17.22 11.16 Favored 'General case' 0 N--CA 1.502 2.131 0 O-C-N 121.554 -0.716 . . . . 0.0 111.595 -179.022 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.499 ' OD1' HG11 ' A' ' 27' ' ' VAL . 5.3 m120 -95.43 -30.91 13.63 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.654 -1.278 . . . . 0.0 111.419 -179.018 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.493 ' SG ' ' HB ' ' A' ' 12' ' ' THR . 13.3 p -133.15 17.94 4.08 Favored 'General case' 0 N--CA 1.498 1.952 0 O-C-N 120.557 -1.34 . . . . 0.0 111.06 179.339 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.438 ' N ' ' O ' ' A' ' 7' ' ' CYS . 26.4 mt-30 44.67 31.78 0.69 Allowed 'General case' 0 N--CA 1.506 2.355 0 O-C-N 121.318 -0.863 . . . . 0.0 112.108 178.801 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.498 HG22 ' CB ' ' A' ' 7' ' ' CYS . 3.2 t -90.61 127.38 36.26 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.655 -1.278 . . . . 0.0 109.376 179.051 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -89.21 -20.48 24.13 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.578 -0.701 . . . . 0.0 109.29 -179.901 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.455 HG21 ' O ' ' A' ' 49' ' ' ASP . 18.7 p -106.79 133.86 50.8 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.209 -0.932 . . . . 0.0 109.021 179.184 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.552 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 8.0 p -146.06 156.59 43.57 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.219 -0.926 . . . . 0.0 110.502 -179.511 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.666 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 43.4 p -87.02 -29.59 21.85 Favored 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 109.281 -0.637 . . . . 0.0 109.281 179.531 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.845 HD11 ' O6 ' ' B' ' 107' ' ' ' DG' . 24.5 mt -146.33 91.01 2.0 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.282 -0.886 . . . . 0.0 109.289 179.697 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.552 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.8 m95 -54.7 102.67 0.07 Allowed 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.947 -1.095 . . . . 0.0 109.545 -179.708 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 tmt_? -101.13 95.22 6.41 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 121.454 -0.779 . . . . 0.0 110.128 -178.935 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 9.3 mmt180 -62.74 110.29 1.69 Allowed 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.194 -0.942 . . . . 0.0 108.895 179.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -71.6 137.78 83.25 Favored Pre-proline 0 N--CA 1.496 1.862 0 O-C-N 121.195 -0.941 . . . . 0.0 110.182 -179.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.1 Cg_exo -56.39 -29.59 77.92 Favored 'Trans proline' 0 C--N 1.319 -1.004 0 C-N-CA 122.701 2.267 . . . . 0.0 110.832 -179.52 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 18.9 ttm -54.88 -25.25 27.68 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.577 -0.702 . . . . 0.0 109.483 178.837 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 111.43 30.92 2.94 Favored Glycine 0 N--CA 1.497 2.726 0 N-CA-C 109.983 -1.247 . . . . 0.0 109.983 179.769 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 2.2 m-20 -140.27 124.34 10.7 Favored Pre-proline 0 N--CA 1.493 1.678 0 O-C-N 121.165 -1.197 . . . . 0.0 110.107 -179.842 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.542 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.7 Cg_endo -65.94 104.16 0.67 Allowed 'Trans proline' 0 C--N 1.314 -1.275 0 C-N-CA 122.143 1.895 . . . . 0.0 109.805 179.293 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.577 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -117.3 127.27 74.84 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-O 122.156 0.979 . . . . 0.0 110.731 -179.8 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.532 ' SG ' ' HB3' ' A' ' 30' ' ' ALA . 12.0 p -48.97 138.32 11.72 Favored 'General case' 0 C--N 1.304 -1.402 0 O-C-N 121.726 -0.609 . . . . 0.0 109.594 179.11 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.671 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 1.6 t-20 -44.68 -33.3 1.79 Allowed 'General case' 0 N--CA 1.503 2.208 0 O-C-N 121.519 -0.738 . . . . 0.0 110.779 -179.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.532 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -54.63 -48.44 72.26 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.088 -1.008 . . . . 0.0 109.584 179.075 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.461 ' SG ' ' HD3' ' A' ' 42' ' ' ARG . 26.8 m -64.18 -39.11 93.31 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.434 -0.791 . . . . 0.0 109.382 179.177 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -69.54 -28.65 72.09 Favored Glycine 0 N--CA 1.496 2.633 0 N-CA-C 110.4 -1.08 . . . . 0.0 110.4 179.622 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.66 ' CD1' ' H62' ' C' ' 124' ' ' ' DA' . 42.5 mt -76.91 -70.1 0.48 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.319 -1.107 . . . . 0.0 110.387 -179.29 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.524 ' HA ' HD13 ' A' ' 37' ' ' LEU . 7.7 t80 -43.83 -35.59 1.99 Allowed 'General case' 0 N--CA 1.502 2.136 0 O-C-N 121.352 -0.843 . . . . 0.0 109.146 179.896 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.528 ' O ' ' HA ' ' A' ' 39' ' ' GLN . 28.6 t80 -58.55 -51.92 67.86 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.481 -0.762 . . . . 0.0 110.527 179.162 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.546 ' HD3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -59.59 -22.43 61.76 Favored 'General case' 0 N--CA 1.5 2.061 0 O-C-N 120.392 -1.442 . . . . 0.0 110.723 -179.534 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.524 HD13 ' HA ' ' A' ' 34' ' ' TYR . 1.9 mp -73.73 -69.32 0.44 Allowed 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.41 -0.806 . . . . 0.0 110.249 -179.888 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.549 ' HB2' HG22 ' A' ' 40' ' ' VAL . 35.5 m-70 -100.96 15.08 29.8 Favored 'General case' 0 N--CA 1.501 2.115 0 O-C-N 121.282 -0.886 . . . . 0.0 110.191 -179.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.528 ' HA ' ' O ' ' A' ' 35' ' ' TYR . 4.4 pm0 36.86 43.88 0.32 Allowed 'General case' 0 N--CA 1.503 2.203 0 CA-C-O 121.547 0.689 . . . . 0.0 111.45 179.953 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.549 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.2 m -132.92 178.4 5.72 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.441 0 O-C-N 121.434 -0.792 . . . . 0.0 109.989 179.627 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.2 p-10 -70.4 172.95 7.49 Favored 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.286 -0.883 . . . . 0.0 110.475 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.461 ' HD3' ' SG ' ' A' ' 31' ' ' CYS . 0.0 OUTLIER -131.83 131.73 22.85 Favored Pre-proline 0 N--CA 1.501 2.123 0 O-C-N 121.306 -0.871 . . . . 0.0 109.226 179.848 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.574 ' HB2' HG22 ' A' ' 45' ' ' THR . 3.3 Cg_endo -68.44 146.56 68.77 Favored 'Trans proline' 0 C--N 1.317 -1.121 0 C-N-CA 122.492 2.128 . . . . 0.0 111.674 -179.498 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.505 ' O ' ' HB3' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -92.93 -3.24 54.88 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.617 -0.677 . . . . 0.0 110.061 178.754 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.574 HG22 ' HB2' ' A' ' 43' ' ' PRO . 2.2 t -63.69 -35.78 81.67 Favored 'General case' 0 N--CA 1.503 2.184 0 O-C-N 120.914 -1.116 . . . . 0.0 110.281 179.911 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 5.4 ttt -84.38 8.56 15.79 Favored 'General case' 0 N--CA 1.5 2.046 0 O-C-N 120.99 -1.069 . . . . 0.0 110.076 179.24 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.505 ' HB3' ' O ' ' A' ' 44' ' ' LEU . 0.3 OUTLIER -75.08 157.38 34.85 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.859 -1.15 . . . . 0.0 109.907 179.831 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.5 tptp -139.33 146.83 40.77 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.247 -0.908 . . . . 0.0 109.232 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . 0.455 ' O ' HG21 ' A' ' 14' ' ' THR . 0.5 OUTLIER -64.89 -39.15 93.08 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.326 -0.859 . . . . 0.0 109.625 179.998 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -98.11 130.66 10.31 Favored Glycine 0 N--CA 1.495 2.632 0 N-CA-C 109.026 -1.629 . . . . 0.0 109.026 178.931 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.59 HG21 HG22 ' A' ' 16' ' ' THR . 5.3 mt -45.93 113.13 0.13 Allowed 'Isoleucine or valine' 0 N--CA 1.499 1.987 0 O-C-N 121.664 -0.904 . . . . 0.0 109.921 -179.754 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 1.8 mt-30 -55.17 149.77 11.91 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 121.689 -0.632 . . . . 0.0 110.309 -179.51 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.88 160.94 40.59 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.129 -0.982 . . . . 0.0 109.462 179.298 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 3.2 mmt180 -151.5 -161.64 1.37 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.655 -0.653 . . . . 0.0 109.858 -179.59 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 42.7 t-20 -55.99 133.66 51.85 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.074 -1.016 . . . . 0.0 108.949 179.27 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -61.32 158.99 13.17 Favored 'General case' 0 N--CA 1.493 1.699 0 CA-C-O 121.607 0.718 . . . . 0.0 110.199 -179.761 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . 0.444 ' HG2' " H4'" ' B' ' 111' ' ' ' DA' . 6.4 ttmt -82.68 135.43 35.02 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.263 -0.898 . . . . 0.0 110.0 179.796 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 13.6 t -74.54 150.42 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 N-CA-C 108.776 -0.824 . . . . 0.0 108.776 179.199 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 5.4 p -64.56 114.2 4.21 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.067 -1.02 . . . . 0.0 109.007 179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 5.6 t . . . . . 0 N--CA 1.497 1.897 0 O-C-N 121.305 -0.872 . . . . 0.0 109.757 -179.084 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.567 ' H62' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.443 1.801 0 O4'-C1'-N19 110.647 3.558 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.528 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.871 1 O4'-C1'-N19 111.912 5.14 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.599 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.469 1 O4'-C1'-N19 111.488 4.611 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.599 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.277 1 O4'-C1'-N19 111.284 4.355 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.523 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.889 0 O4'-C1'-N19 110.912 3.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.425 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.857 0 O4'-C1'-N19 110.925 3.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.425 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.931 1 O4'-C1'-N19 111.325 4.407 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.422 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.611 1.81 0 O4'-C1'-N19 110.391 3.239 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.678 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.752 1 O4'-C1'-N19 111.562 4.703 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.678 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.654 1 O4'-C1'-N19 112.087 5.358 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.557 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.657 1 O4'-C1'-N19 111.307 4.384 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.49 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.098 0 O4'-C1'-N19 110.635 3.544 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.595 ' H62' ' CD1' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.357 0 O4'-C1'-N19 110.584 3.48 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.525 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.532 2.586 1 O4'-C1'-N19 112.515 5.894 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.498 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.063 0 O4'-C1'-N19 110.796 3.744 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.453 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.07 0 O4'-C1'-N19 110.899 3.874 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . 0.422 ' O ' ' N ' ' A' ' 3' ' ' ALA . 5.6 mttt . . . . . 0 N--CA 1.5 2.047 0 N-CA-C 110.427 -0.212 . . . . 0.0 110.427 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -49.95 90.81 0.0 OUTLIER 'General case' 0 N--CA 1.507 2.383 0 O-C-N 121.48 -0.763 . . . . 0.0 110.665 -179.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.422 ' N ' ' O ' ' A' ' 1' ' ' LYS . . . -64.21 90.98 0.07 Allowed 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.54 -0.725 . . . . 0.0 109.834 -179.445 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 53.42 36.64 53.94 Favored Glycine 0 N--CA 1.494 2.539 0 N-CA-C 109.398 -1.481 . . . . 0.0 109.398 -179.371 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.449 ' O ' ' CH2' ' A' ' 18' ' ' TRP . 25.2 m -55.45 94.54 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.553 -0.969 . . . . 0.0 109.857 -179.658 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 3.4 m -89.95 112.31 24.46 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 179.138 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.587 ' HB3' HG22 ' A' ' 12' ' ' THR . 38.7 t -44.18 109.44 0.15 Allowed 'General case' 0 N--CA 1.498 1.949 0 O-C-N 121.498 -0.751 . . . . 0.0 110.669 -178.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 44.7 m -57.73 -20.08 32.12 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.11 -0.994 . . . . 0.0 111.72 -179.073 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.455 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 9.4 m-20 -85.67 -30.74 22.96 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.951 -1.093 . . . . 0.0 110.786 -179.87 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.578 ' HB2' ' HB3' ' A' ' 44' ' ' LEU . 18.6 p -141.86 24.84 2.0 Allowed 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.666 -1.271 . . . . 0.0 111.103 179.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.512 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.0 OUTLIER 40.36 26.95 0.03 OUTLIER 'General case' 0 N--CA 1.508 2.464 0 O-C-N 121.786 -0.571 . . . . 0.0 111.936 179.811 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.587 HG22 ' HB3' ' A' ' 7' ' ' CYS . 5.7 t -85.65 130.13 34.65 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.779 -1.201 . . . . 0.0 109.531 179.518 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 29.4 t -90.66 6.12 45.21 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.533 -0.73 . . . . 0.0 109.292 179.717 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.48 ' HB ' ' CG1' ' A' ' 51' ' ' ILE . 14.5 p -125.82 124.55 41.2 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.259 -0.901 . . . . 0.0 109.57 -179.652 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.634 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 9.6 p -145.3 146.44 31.64 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.036 -1.04 . . . . 0.0 110.387 -179.562 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.525 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 22.5 p -67.04 -38.54 86.07 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 179.007 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.567 HD11 ' H62' ' B' ' 106' ' ' ' DA' . 11.6 mt -149.86 107.61 3.68 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.677 -0.86 . . . . 0.0 108.677 179.208 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.634 ' CZ3' HG21 ' A' ' 15' ' ' THR . 40.9 m95 -59.27 94.83 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.515 -0.74 . . . . 0.0 110.262 -179.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -80.04 87.67 5.42 Favored 'General case' 0 N--CA 1.487 1.422 0 O-C-N 121.371 -0.83 . . . . 0.0 108.951 179.684 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -62.11 102.8 0.32 Allowed 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.402 -0.811 . . . . 0.0 109.43 -179.703 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 2.1 t -67.59 136.98 93.02 Favored Pre-proline 0 N--CA 1.496 1.863 0 O-C-N 121.351 -0.843 . . . . 0.0 110.169 -179.452 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -58.98 -30.12 92.45 Favored 'Trans proline' 0 C--N 1.317 -1.099 0 C-N-CA 122.625 2.217 . . . . 0.0 110.924 179.812 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -57.67 -24.91 59.15 Favored 'General case' 0 N--CA 1.499 2.01 0 O-C-N 121.223 -0.923 . . . . 0.0 109.281 179.397 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 113.2 33.9 1.89 Allowed Glycine 0 N--CA 1.496 2.666 0 N-CA-C 109.948 -1.261 . . . . 0.0 109.948 179.74 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 3.6 m-20 -136.77 109.27 9.25 Favored Pre-proline 0 N--CA 1.494 1.747 0 O-C-N 121.21 -1.171 . . . . 0.0 110.596 -179.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.535 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 5.8 Cg_exo -62.36 102.6 0.28 Allowed 'Trans proline' 0 C--N 1.315 -1.21 0 C-N-CA 122.155 1.903 . . . . 0.0 109.464 178.645 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.458 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -111.69 155.89 12.93 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 120.977 -1.077 . . . . 0.0 110.943 -179.345 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.507 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 15.3 p -82.32 139.58 34.06 Favored 'General case' 0 C--N 1.304 -1.395 0 N-CA-C 108.984 -0.747 . . . . 0.0 108.984 179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -38.04 -44.23 0.79 Allowed 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.762 -0.586 . . . . 0.0 111.413 -179.016 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -56.28 -48.62 76.24 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.24 -0.912 . . . . 0.0 111.239 -179.63 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.475 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 3.6 m -56.29 -49.78 73.29 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.265 -0.897 . . . . 0.0 108.663 179.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -59.09 -38.46 93.07 Favored Glycine 0 N--CA 1.494 2.554 0 N-CA-C 109.976 -1.25 . . . . 0.0 109.976 179.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.595 ' CD1' ' H62' ' C' ' 124' ' ' ' DA' . 44.8 mt -67.72 -67.75 0.44 Allowed 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.492 -1.005 . . . . 0.0 110.13 -180.0 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.403 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 89.4 t80 -52.74 -37.36 59.18 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 121.445 -0.785 . . . . 0.0 109.256 179.899 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.575 ' O ' ' N ' ' A' ' 39' ' ' GLN . 43.3 t80 -60.74 -45.65 93.46 Favored 'General case' 0 C--O 1.2 -1.523 0 O-C-N 121.414 -0.804 . . . . 0.0 108.917 179.064 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -56.39 -29.74 61.86 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 120.194 -1.566 . . . . 0.0 110.06 179.187 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.403 ' HB2' ' O ' ' A' ' 34' ' ' TYR . 5.4 mp -64.74 -65.82 0.62 Allowed 'General case' 0 N--CA 1.502 2.163 0 O-C-N 120.945 -1.097 . . . . 0.0 110.122 -179.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 36.6 m-70 -94.61 -32.73 13.28 Favored 'General case' 0 N--CA 1.507 2.38 0 O-C-N 121.228 -0.92 . . . . 0.0 109.977 -179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.575 ' N ' ' O ' ' A' ' 35' ' ' TYR . 21.7 tt0 72.87 46.09 0.27 Allowed 'General case' 0 N--CA 1.499 1.992 0 CA-C-O 121.734 0.778 . . . . 0.0 110.577 179.457 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 m -140.34 167.69 18.09 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.295 0 O-C-N 121.395 -0.815 . . . . 0.0 109.219 179.173 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -85.16 129.88 34.72 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.065 -1.022 . . . . 0.0 109.036 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -130.17 146.38 61.31 Favored Pre-proline 0 N--CA 1.494 1.773 0 O-C-N 121.188 -0.945 . . . . 0.0 109.882 -179.319 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_endo -60.0 144.31 99.48 Favored 'Trans proline' 0 C--N 1.317 -1.105 0 C-N-CA 122.622 2.215 . . . . 0.0 111.314 -179.636 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.722 HD12 ' HB2' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -78.89 48.01 0.8 Allowed 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.121 -0.987 . . . . 0.0 110.739 -179.879 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.5 t -66.31 -12.19 55.15 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.133 -0.98 . . . . 0.0 110.141 178.914 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -103.32 -2.28 27.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.988 -1.07 . . . . 0.0 110.565 179.489 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.722 ' HB2' HD12 ' A' ' 44' ' ' LEU . 0.0 OUTLIER -67.1 157.93 32.4 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 120.631 -1.293 . . . . 0.0 110.256 -179.839 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 33.0 mttt -143.51 -163.84 1.74 Allowed 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.586 -0.696 . . . . 0.0 109.487 -179.855 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.7 OUTLIER -78.53 -74.01 0.3 Allowed 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.211 -0.931 . . . . 0.0 110.015 -179.866 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -92.45 161.74 26.44 Favored Glycine 0 N--CA 1.497 2.71 0 N-CA-C 109.718 -1.353 . . . . 0.0 109.718 179.908 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.48 ' CG1' ' HB ' ' A' ' 14' ' ' THR . 7.6 mt -55.32 135.43 18.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.238 -1.154 . . . . 0.0 110.096 179.91 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.7 mt-30 -69.87 150.02 47.24 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.363 -0.836 . . . . 0.0 109.248 179.072 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.63 160.85 40.76 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.112 -0.993 . . . . 0.0 109.763 179.548 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.411 ' CZ ' H5'' ' B' ' 113' ' ' ' DC' . 0.5 OUTLIER -151.21 175.96 11.67 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.923 -0.769 . . . . 0.0 108.923 179.799 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.0 t-20 -63.49 93.05 0.07 Allowed 'General case' 0 N--CA 1.489 1.482 0 N-CA-C 108.214 -1.032 . . . . 0.0 108.214 178.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.421 ' HD2' ' OP1' ' C' ' 126' ' ' ' DC' . 1.8 ptt180 -47.55 130.22 13.86 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.662 -0.649 . . . . 0.0 110.503 -178.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -47.28 138.4 7.28 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.688 -0.633 . . . . 0.0 110.069 -179.791 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.4 OUTLIER -55.2 155.29 1.14 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.475 -0.765 . . . . 0.0 110.12 -179.465 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -46.9 118.72 2.18 Favored 'General case' 0 N--CA 1.499 1.978 0 O-C-N 121.77 -0.582 . . . . 0.0 110.736 -179.68 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 33.1 t . . . . . 0 N--CA 1.497 1.924 0 O-C-N 121.374 -0.829 . . . . 0.0 110.156 179.833 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.537 ' C6 ' ' C6 ' ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.444 1.818 0 O4'-C1'-N19 110.669 3.586 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.724 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.525 1.764 1 O4'-C1'-N19 111.565 4.706 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.594 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.104 1 O4'-C1'-N19 111.023 4.028 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.594 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.752 0 O4'-C1'-N19 110.465 3.332 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.49 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.445 1.906 0 O4'-C1'-N19 110.738 3.672 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.424 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.12 0 O4'-C1'-N19 110.94 3.925 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.883 1 O4'-C1'-N19 111.333 4.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.612 1.929 0 C3'-C2'-C1' 107.149 3.178 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.678 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.787 1 O4'-C1'-N19 111.361 4.452 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.678 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.476 1 O4'-C1'-N19 111.885 5.106 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.507 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.965 1 O4'-C1'-N19 111.262 4.327 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.542 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.442 1.708 0 O4'-C1'-N19 110.444 3.305 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.582 " H2'" ' H71' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.639 0 O4'-C1'-N19 110.791 3.739 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.596 H2'' " O5'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.933 1 O4'-C1'-N19 111.566 4.708 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.596 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.476 0 O4'-C1'-N19 110.722 3.652 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.484 ' C6 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.552 1 O4'-C1'-N19 111.197 4.247 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 4.1 tttp . . . . . 0 N--CA 1.496 1.861 0 N-CA-C 109.594 -0.521 . . . . 0.0 109.594 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 17.7 mmm180 -99.27 46.11 0.98 Allowed 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.945 -1.097 . . . . 0.0 109.651 179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.02 114.49 1.96 Allowed 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.29 -0.881 . . . . 0.0 109.403 179.766 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.46 -35.58 2.89 Favored Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.281 -1.528 . . . . 0.0 109.281 -179.057 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.558 HG23 ' HB2' ' A' ' 26' ' ' PRO . 3.5 m -64.68 93.77 0.11 Allowed 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.282 -1.128 . . . . 0.0 109.094 179.303 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.8 m -98.65 137.64 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 N-CA-C 108.644 -0.872 . . . . 0.0 108.644 179.912 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.641 ' HB2' HG22 ' A' ' 12' ' ' THR . 9.4 t -56.16 117.61 3.92 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.47 -0.769 . . . . 0.0 110.659 -179.384 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -58.52 -16.28 14.78 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.466 -0.771 . . . . 0.0 110.979 179.934 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.496 ' OD1' ' HD3' ' A' ' 42' ' ' ARG . 4.5 m-80 -109.42 -24.96 10.77 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.923 -1.111 . . . . 0.0 111.569 -179.18 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.465 ' HA ' ' HB3' ' A' ' 44' ' ' LEU . 4.8 p -140.23 19.82 2.42 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.491 -1.38 . . . . 0.0 111.466 179.491 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 4.6 mm-40 39.24 34.81 0.13 Allowed 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.554 -0.716 . . . . 0.0 112.841 178.066 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.641 HG22 ' HB2' ' A' ' 7' ' ' CYS . 11.0 t -89.18 132.49 34.82 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 120.61 -1.306 . . . . 0.0 108.822 178.524 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -92.74 -25.11 18.34 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.471 -0.768 . . . . 0.0 110.191 -179.24 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.527 ' HB ' HG13 ' A' ' 51' ' ' ILE . 68.9 p -103.88 114.8 29.32 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.167 -0.958 . . . . 0.0 109.209 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . . . . . . . . . 12.2 p -130.4 161.55 31.1 Favored 'General case' 0 N--CA 1.494 1.762 0 C-N-CA 119.664 -0.814 . . . . 0.0 110.594 -179.587 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.495 HG21 " H2'" ' C' ' 124' ' ' ' DA' . 6.4 p -82.8 -36.46 25.56 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 178.846 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.724 HD11 ' O6 ' ' B' ' 107' ' ' ' DG' . 17.8 mt -143.05 106.09 4.54 Favored 'General case' 0 N--CA 1.492 1.669 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 178.887 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.55 ' CH2' HG22 ' A' ' 5' ' ' THR . 16.3 m95 -64.27 107.21 1.26 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.373 -0.829 . . . . 0.0 110.391 -179.588 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.602 ' HB3' HG23 ' A' ' 27' ' ' VAL . 6.8 tpt180 -81.66 72.97 8.72 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.254 -0.904 . . . . 0.0 108.719 179.196 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.434 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 10.7 tpp180 -63.52 92.42 0.06 Allowed 'General case' 0 N--CA 1.493 1.714 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 179.614 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -61.0 143.79 91.51 Favored Pre-proline 0 N--CA 1.499 1.979 0 O-C-N 121.338 -0.851 . . . . 0.0 110.354 -178.629 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -54.5 -42.56 66.94 Favored 'Trans proline' 0 C--N 1.32 -0.967 0 C-N-CA 122.632 2.221 . . . . 0.0 111.09 -179.294 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -59.01 -21.16 58.58 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.283 -0.886 . . . . 0.0 109.972 179.31 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.34 42.13 1.19 Allowed Glycine 0 N--CA 1.497 2.719 0 N-CA-C 109.68 -1.368 . . . . 0.0 109.68 179.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 18.6 m-20 -128.7 92.82 39.28 Favored Pre-proline 0 N--CA 1.493 1.687 0 O-C-N 121.373 -1.075 . . . . 0.0 110.091 -179.585 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.558 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.3 Cg_endo -64.35 95.2 0.21 Allowed 'Trans proline' 0 C--N 1.316 -1.164 0 C-N-CA 122.51 2.14 . . . . 0.0 110.003 179.174 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.602 HG23 ' HB3' ' A' ' 19' ' ' ARG . 2.4 m -114.05 123.26 69.55 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.071 -1.018 . . . . 0.0 110.655 -179.731 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.41 ' HB3' ' CG2' ' A' ' 12' ' ' THR . 6.5 p -45.63 132.62 8.36 Favored 'General case' 0 N--CA 1.488 1.439 0 O-C-N 121.27 -0.894 . . . . 0.0 109.947 179.219 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.445 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 6.4 t-20 -37.48 -42.45 0.52 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.61 -0.681 . . . . 0.0 111.825 -178.688 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.543 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -49.78 -46.29 50.58 Favored 'General case' 0 N--CA 1.501 2.118 0 O-C-N 121.24 -0.913 . . . . 0.0 110.217 179.925 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.412 ' O ' ' HG2' ' A' ' 42' ' ' ARG . 33.0 m -66.75 -33.61 76.02 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.327 -0.858 . . . . 0.0 109.352 179.378 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -65.01 -38.61 95.66 Favored Glycine 0 N--CA 1.493 2.468 0 N-CA-C 109.156 -1.577 . . . . 0.0 109.156 179.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.52 ' O ' ' HG3' ' A' ' 36' ' ' LYS . 95.2 mt -73.09 -58.01 3.62 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.526 -0.985 . . . . 0.0 110.045 179.885 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.422 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 29.6 t80 -46.14 -37.34 6.82 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.198 -0.938 . . . . 0.0 109.559 179.756 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.508 ' O ' ' N ' ' A' ' 39' ' ' GLN . 18.5 t80 -60.7 -55.42 33.4 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.37 -0.831 . . . . 0.0 110.413 179.606 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.52 ' HG3' ' O ' ' A' ' 33' ' ' LEU . 0.0 OUTLIER -57.29 -24.1 52.74 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 120.575 -1.328 . . . . 0.0 110.802 -179.556 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.475 HD12 ' HG3' ' A' ' 36' ' ' LYS . 5.7 mp -65.3 -67.19 0.46 Allowed 'General case' 0 N--CA 1.5 2.045 0 O-C-N 121.345 -0.847 . . . . 0.0 109.823 179.432 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.519 ' O ' ' CG ' ' A' ' 39' ' ' GLN . 66.1 m-70 -97.16 -29.5 13.56 Favored 'General case' 0 N--CA 1.504 2.253 0 O-C-N 121.295 -0.878 . . . . 0.0 110.395 -179.776 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.519 ' CG ' ' O ' ' A' ' 38' ' ' HIS . 0.1 OUTLIER 87.4 27.5 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.571 0 CA-C-O 121.609 0.719 . . . . 0.0 110.574 -179.596 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.9 m -124.63 -171.0 0.67 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.597 0 O-C-N 121.078 -1.014 . . . . 0.0 109.629 179.05 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -58.17 175.64 0.21 Allowed 'General case' 0 N--CA 1.499 1.984 0 O-C-N 121.058 -1.027 . . . . 0.0 109.378 179.3 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.496 ' HD3' ' OD1' ' A' ' 9' ' ' ASN . 1.6 mpt_? -119.8 132.86 23.9 Favored Pre-proline 0 N--CA 1.495 1.804 0 O-C-N 120.909 -1.119 . . . . 0.0 109.805 -179.978 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -62.8 126.32 17.9 Favored 'Trans proline' 0 C--N 1.317 -1.119 0 C-N-CA 122.39 2.06 . . . . 0.0 110.965 -179.778 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.465 ' HB3' ' HA ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -94.16 -19.72 20.52 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.422 -0.799 . . . . 0.0 110.123 179.521 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.5 OUTLIER -58.22 -34.33 70.3 Favored 'General case' 0 N--CA 1.503 2.22 0 O-C-N 121.218 -0.926 . . . . 0.0 110.423 179.901 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -74.74 -29.81 61.29 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.243 -0.911 . . . . 0.0 109.482 179.506 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.505 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -64.16 141.75 58.66 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.365 -0.835 . . . . 0.0 109.34 179.795 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.9 tttt -104.42 178.27 4.61 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.282 -0.886 . . . . 0.0 110.15 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 9.8 m-20 -74.94 -33.69 61.98 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.338 -0.852 . . . . 0.0 110.265 -179.831 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -114.09 149.03 18.77 Favored Glycine 0 N--CA 1.497 2.757 0 N-CA-C 109.079 -1.609 . . . . 0.0 109.079 179.278 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.527 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.2 mt -46.35 107.77 0.06 OUTLIER 'Isoleucine or valine' 0 N--CA 1.498 1.971 0 O-C-N 121.545 -0.974 . . . . 0.0 110.128 -179.671 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.404 ' O ' H5'' ' C' ' 124' ' ' ' DA' . 7.1 mt-30 -52.3 147.59 7.67 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.769 -0.826 . . . . 0.0 108.769 179.393 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.34 161.75 40.99 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 120.49 -1.381 . . . . 0.0 109.984 179.858 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -150.46 -152.37 0.43 Allowed 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 -179.396 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.8 t-20 -60.02 114.31 2.77 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 120.808 -1.182 . . . . 0.0 107.944 178.671 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 38.8 ttm180 -47.17 133.71 11.59 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.665 -0.647 . . . . 0.0 109.864 -179.295 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 8.0 ttpp -50.11 106.9 0.13 Allowed 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 179.451 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.414 HG13 ' H ' ' A' ' 58' ' ' VAL . 3.6 m -55.67 152.65 1.88 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.69 0 O-C-N 121.544 -0.722 . . . . 0.0 110.053 -178.783 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.9 OUTLIER -70.77 74.88 0.6 Allowed 'General case' 0 N--CA 1.488 1.438 0 O-C-N 121.435 -0.791 . . . . 0.0 109.579 -179.967 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 34.9 t . . . . . 0 N--CA 1.498 1.97 0 O-C-N 121.309 -0.87 . . . . 0.0 109.262 179.899 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.555 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.445 1.931 0 O4'-C1'-N19 110.818 3.772 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.555 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.441 1.634 1 O4'-C1'-N19 111.44 4.55 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.583 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.019 1 O4'-C1'-N19 111.07 4.088 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.583 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.039 1 O4'-C1'-N19 111.347 4.434 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.539 ' C2 ' ' C2 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.732 1 O4'-C1'-N19 111.024 4.03 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.539 ' C2 ' ' C2 ' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.921 0 O4'-C1'-N19 110.83 3.787 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.41 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.028 1 O4'-C1'-N19 111.206 4.258 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.41 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.613 2.048 0 O4'-C1'-N19 110.72 3.651 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.649 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.968 1 O4'-C1'-N19 111.83 5.037 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.649 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.577 1 O4'-C1'-N19 112.275 5.594 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.405 " O5'" H2'' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.16 1 O4'-C1'-N19 112.164 5.455 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.502 ' OP2' ' HB2' ' A' ' 34' ' ' TYR . . . . . . . . 0 C5'--C4' 1.529 2.236 0 O4'-C1'-N19 110.54 3.426 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.956 ' OP2' ' HB2' ' A' ' 30' ' ' ALA . . . . . . . . 0 O4'--C1' 1.445 1.922 1 O4'-C1'-N19 111.476 4.595 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.612 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.527 1.981 1 O4'-C1'-N19 112.11 5.387 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.556 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.642 0 O4'-C1'-N19 110.852 3.815 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.428 ' H71' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.908 0 O4'-C1'-N19 110.688 3.611 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.493 1.712 0 N-CA-C 109.563 -0.532 . . . . 0.0 109.563 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 11.8 mmm180 -90.21 59.82 4.57 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 121.41 -0.806 . . . . 0.0 109.76 179.782 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.49 140.53 58.61 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.324 -0.86 . . . . 0.0 109.419 179.712 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 105.79 -30.38 9.84 Favored Glycine 0 N--CA 1.496 2.657 0 N-CA-C 109.524 -1.43 . . . . 0.0 109.524 -179.221 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.442 HG22 ' CH2' ' A' ' 18' ' ' TRP . 92.7 m -72.61 89.1 1.29 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.188 -1.183 . . . . 0.0 109.579 179.555 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.455 HG23 ' O ' ' A' ' 6' ' ' VAL . 32.7 m -85.61 122.13 38.04 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.523 0 N-CA-C 108.06 -1.089 . . . . 0.0 108.06 179.236 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.497 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 53.4 t -56.02 113.9 1.71 Allowed 'General case' 0 N--CA 1.494 1.759 0 O-C-N 120.932 -1.105 . . . . 0.0 110.05 -178.847 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.9 m -60.8 -12.96 12.41 Favored 'General case' 0 N--CA 1.5 2.074 0 O-C-N 121.366 -0.833 . . . . 0.0 111.24 -179.606 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 4.7 m-20 -99.13 -31.22 11.86 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.82 -1.175 . . . . 0.0 110.702 -179.71 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.484 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 15.0 p -139.42 24.26 2.48 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 120.56 -1.338 . . . . 0.0 111.424 -179.969 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER 43.04 23.9 0.03 OUTLIER 'General case' 0 N--CA 1.511 2.593 0 O-C-N 121.215 -0.928 . . . . 0.0 112.71 178.593 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.462 ' H ' ' HB3' ' A' ' 7' ' ' CYS . 5.5 t -86.83 132.1 33.93 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 120.373 -1.454 . . . . 0.0 110.236 -179.987 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -91.35 -25.62 19.31 Favored 'General case' 0 N--CA 1.494 1.763 0 N-CA-C 109.104 -0.702 . . . . 0.0 109.104 179.4 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.6 p -97.39 117.58 31.94 Favored 'General case' 0 N--CA 1.495 1.813 0 O-C-N 121.326 -0.859 . . . . 0.0 109.374 179.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.456 HG21 ' CH2' ' A' ' 18' ' ' TRP . 18.0 p -132.43 156.04 47.42 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.157 -0.965 . . . . 0.0 111.004 -179.241 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.666 HG21 " H3'" ' C' ' 124' ' ' ' DA' . 28.6 p -83.22 -40.93 18.99 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 109.092 -0.707 . . . . 0.0 109.092 179.442 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.596 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 16.6 mt -139.56 92.36 2.56 Favored 'General case' 0 N--CA 1.496 1.87 0 N-CA-C 108.91 -0.774 . . . . 0.0 108.91 179.475 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.456 ' CH2' HG21 ' A' ' 15' ' ' THR . 10.5 m95 -57.6 127.97 34.72 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.195 -0.94 . . . . 0.0 110.148 -179.713 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 13.3 mtt180 -116.16 86.07 2.41 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.379 -0.826 . . . . 0.0 109.122 179.399 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.46 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 12.8 mmm180 -62.63 102.73 0.36 Allowed 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.371 -0.831 . . . . 0.0 109.314 -179.831 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.481 ' HB2' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -63.65 143.57 97.95 Favored Pre-proline 0 N--CA 1.498 1.941 0 O-C-N 121.165 -0.959 . . . . 0.0 110.263 -179.292 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.0 Cg_exo -53.99 -44.01 53.11 Favored 'Trans proline' 0 C--N 1.318 -1.03 0 C-N-CA 122.866 2.377 . . . . 0.0 111.26 -179.141 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.77 -22.12 45.28 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.313 -0.867 . . . . 0.0 109.941 179.376 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.0 38.35 1.41 Allowed Glycine 0 N--CA 1.497 2.759 0 N-CA-C 109.868 -1.293 . . . . 0.0 109.868 179.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.481 ' O ' ' HB2' ' A' ' 21' ' ' SER . 15.8 m-20 -128.51 98.21 26.13 Favored Pre-proline 0 N--CA 1.494 1.726 0 O-C-N 121.324 -1.104 . . . . 0.0 110.082 -179.6 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.497 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 1.9 Cg_endo -64.83 101.5 0.39 Allowed 'Trans proline' 0 C--N 1.311 -1.411 0 C-N-CA 121.956 1.771 . . . . 0.0 109.866 179.427 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.49 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -115.01 126.29 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.887 0 O-C-N 121.209 -0.932 . . . . 0.0 110.281 -179.976 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.453 ' SG ' ' HB3' ' A' ' 30' ' ' ALA . 6.8 p -50.4 135.69 21.69 Favored 'General case' 0 N--CA 1.485 1.279 0 O-C-N 121.698 -0.626 . . . . 0.0 109.421 179.407 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.596 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t-20 -38.17 -43.81 0.8 Allowed 'General case' 0 N--CA 1.506 2.329 0 O-C-N 121.564 -0.71 . . . . 0.0 111.384 -178.968 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.956 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -48.15 -45.31 33.12 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.525 -0.735 . . . . 0.0 110.359 -179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.531 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 51.3 m -70.3 -35.45 73.71 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.436 -0.79 . . . . 0.0 109.556 179.64 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -64.77 -31.73 81.87 Favored Glycine 0 N--CA 1.496 2.658 0 N-CA-C 110.32 -1.112 . . . . 0.0 110.32 179.493 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.728 HD11 ' H62' ' C' ' 124' ' ' ' DA' . 96.8 mt -79.25 -61.22 2.08 Favored 'General case' 0 N--CA 1.499 2.015 0 O-C-N 121.248 -1.148 . . . . 0.0 110.079 -179.859 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.578 ' CE2' ' HB2' ' A' ' 42' ' ' ARG . 33.1 t80 -50.79 -36.03 34.94 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.379 -0.826 . . . . 0.0 108.886 179.688 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.561 ' O ' ' N ' ' A' ' 39' ' ' GLN . 18.5 t80 -59.45 -53.68 55.34 Favored 'General case' 0 C--O 1.199 -1.559 0 O-C-N 121.54 -0.725 . . . . 0.0 109.669 179.26 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.639 ' HD3' HD12 ' A' ' 37' ' ' LEU . 0.0 OUTLIER -55.02 -27.41 44.19 Favored 'General case' 0 N--CA 1.502 2.154 0 O-C-N 119.918 -1.739 . . . . 0.0 110.267 179.616 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.639 HD12 ' HD3' ' A' ' 36' ' ' LYS . 0.4 OUTLIER -66.57 -71.14 0.21 Allowed 'General case' 0 N--CA 1.504 2.235 0 O-C-N 120.896 -1.128 . . . . 0.0 109.92 179.614 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.445 ' HB2' HG22 ' A' ' 40' ' ' VAL . 25.1 m-70 -96.19 -28.6 14.48 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.204 -0.935 . . . . 0.0 109.56 179.734 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.561 ' N ' ' O ' ' A' ' 35' ' ' TYR . 21.5 tt0 73.3 52.43 0.13 Allowed 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 122.163 0.983 . . . . 0.0 110.336 179.488 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.445 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.3 m -141.34 170.49 13.32 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.099 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 3.8 p30 -78.54 126.04 30.2 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.814 -1.179 . . . . 0.0 109.981 -179.966 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.578 ' HB2' ' CE2' ' A' ' 34' ' ' TYR . 1.0 OUTLIER -102.57 131.86 21.94 Favored Pre-proline 0 N--CA 1.499 1.998 0 O-C-N 121.037 -1.04 . . . . 0.0 109.77 -179.55 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.759 ' HB2' HG23 ' A' ' 45' ' ' THR . 1.0 OUTLIER -64.51 150.66 87.85 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.283 1.989 . . . . 0.0 110.334 178.967 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.484 ' HB3' ' O ' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -84.67 30.77 0.55 Allowed 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.002 -1.061 . . . . 0.0 110.406 179.699 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.759 HG23 ' HB2' ' A' ' 43' ' ' PRO . 33.8 p -70.68 -17.14 62.85 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.129 -0.982 . . . . 0.0 109.948 179.498 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -96.56 1.68 51.57 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.987 -1.071 . . . . 0.0 110.428 179.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.481 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -79.05 166.45 22.3 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 120.807 -1.183 . . . . 0.0 109.706 179.655 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 11.8 tptt -134.42 -172.55 3.04 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.36 -0.837 . . . . 0.0 109.469 179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 15.3 m-20 -59.85 -50.71 72.72 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.309 -0.869 . . . . 0.0 110.027 -179.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.11 171.77 15.82 Favored Glycine 0 N--CA 1.494 2.501 0 N-CA-C 109.446 -1.462 . . . . 0.0 109.446 179.804 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.644 ' CG2' HG22 ' A' ' 16' ' ' THR . 5.3 mt -49.55 125.72 3.58 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.488 -1.007 . . . . 0.0 109.995 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.486 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.1 OUTLIER -71.25 154.81 41.36 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.554 -0.716 . . . . 0.0 110.203 -179.855 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.466 ' HB ' ' OP1' ' C' ' 125' ' ' ' DT' . 0.1 OUTLIER -156.32 154.08 30.04 Favored 'General case' 0 N--CA 1.497 1.915 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 177.843 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.454 ' NH1' ' HG2' ' A' ' 54' ' ' ARG . 0.4 OUTLIER -151.67 -164.94 2.1 Favored 'General case' 0 N--CA 1.498 1.966 0 N-CA-C 109.5 -0.556 . . . . 0.0 109.5 -179.431 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 44.5 t30 -65.57 89.74 0.11 Allowed 'General case' 0 N--CA 1.496 1.86 0 O-C-N 120.995 -1.066 . . . . 0.0 108.158 178.725 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.525 ' HD2' " O3'" ' C' ' 125' ' ' ' DT' . 0.5 OUTLIER -64.77 175.52 1.45 Allowed 'General case' 0 N--CA 1.49 1.568 0 CA-C-O 121.564 0.697 . . . . 0.0 110.365 -178.903 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 22.1 ttpt -56.88 111.13 0.94 Allowed 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.626 -0.671 . . . . 0.0 109.608 179.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.7 p -52.34 146.65 2.08 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 N-CA-C 108.975 -0.75 . . . . 0.0 108.975 179.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 30.7 t -47.47 120.27 3.17 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.178 -0.952 . . . . 0.0 110.378 -179.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 15.1 t . . . . . 0 N--CA 1.496 1.875 0 O-C-N 121.702 -0.624 . . . . 0.0 110.082 -179.791 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.579 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.895 0 O4'-C1'-N19 110.521 3.401 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.579 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.875 1 O4'-C1'-N19 111.43 4.537 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.618 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.892 0 O4'-C1'-N19 110.892 3.865 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.618 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.805 1 O4'-C1'-N19 111.238 4.297 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.587 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.611 1.803 0 O4'-C1'-N19 110.64 3.55 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.795 0 O4'-C1'-N19 110.952 3.94 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.468 " O3'" ' HD3' ' A' ' 54' ' ' ARG . . . . . . . . 0 P--O5' 1.61 1.722 1 O4'-C1'-N19 111.4 4.5 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.814 0 O4'-C1'-N19 110.402 3.252 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.661 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.927 0 O4'-C1'-N19 110.831 3.789 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.661 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.615 1 O4'-C1'-N19 111.945 5.181 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.609 ' H71' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.165 1 O4'-C1'-N19 111.096 4.12 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.489 ' C7 ' HD13 ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.339 0 O4'-C1'-N19 110.633 3.541 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.579 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.473 0 O4'-C1'-N19 110.541 3.427 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.64 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.415 1 O4'-C1'-N19 112.651 6.064 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.517 " H2'" ' C5 ' ' C' ' 127' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.62 0 O4'-C1'-N19 110.828 3.785 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.517 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.526 1.899 0 O4'-C1'-N19 110.894 3.868 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.8 tttt . . . . . 0 N--CA 1.498 1.962 0 CA-C-O 121.053 0.454 . . . . 0.0 110.349 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.479 ' HA ' ' NE ' ' A' ' 2' ' ' ARG . 1.4 mmp_? -100.59 -13.57 18.54 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 120.919 -1.113 . . . . 0.0 109.916 179.303 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.26 111.21 3.86 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.1 -1.0 . . . . 0.0 108.986 179.321 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.22 -14.77 6.52 Favored Glycine 0 N--CA 1.497 2.729 0 N-CA-C 109.977 -1.249 . . . . 0.0 109.977 -179.082 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.658 HG23 ' HB2' ' A' ' 26' ' ' PRO . 4.3 m -62.81 89.36 0.03 OUTLIER 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.085 -1.244 . . . . 0.0 109.631 179.952 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 6' ' ' VAL . 35.0 m -82.48 114.27 23.07 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.68 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.481 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.539 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 45.3 t -49.35 110.08 0.33 Allowed 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.253 -0.904 . . . . 0.0 110.468 -178.701 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 8.2 m -60.37 -13.22 11.99 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.171 -0.955 . . . . 0.0 111.149 -179.729 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.519 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 1.0 OUTLIER -92.54 -30.96 15.39 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 120.822 -1.174 . . . . 0.0 110.69 -179.654 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.519 ' SG ' ' HD2' ' A' ' 47' ' ' ARG . 16.9 p -141.82 24.87 2.0 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 120.932 -1.105 . . . . 0.0 111.175 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.426 ' N ' ' O ' ' A' ' 7' ' ' CYS . 0.8 OUTLIER 42.67 27.61 0.1 Allowed 'General case' 0 N--CA 1.508 2.449 0 O-C-N 121.308 -0.87 . . . . 0.0 112.229 179.085 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.509 HG22 ' CB ' ' A' ' 7' ' ' CYS . 6.9 t -89.88 127.49 36.01 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 120.657 -1.277 . . . . 0.0 109.975 179.842 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -90.71 -12.59 36.19 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.534 -0.729 . . . . 0.0 109.63 179.775 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.464 ' HB ' HG13 ' A' ' 51' ' ' ILE . 30.0 p -113.35 126.1 55.0 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.213 -0.93 . . . . 0.0 108.576 179.219 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.561 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 20.3 p -139.96 160.85 38.99 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 121.13 -0.981 . . . . 0.0 110.228 -179.238 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.64 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 44.6 p -91.67 -26.1 18.81 Favored 'General case' 0 C--N 1.3 -1.566 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 179.526 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.696 ' HB2' ' CB ' ' A' ' 29' ' ' ASN . 63.4 mt -144.09 87.45 1.9 Allowed 'General case' 0 N--CA 1.496 1.861 0 N-CA-C 108.628 -0.879 . . . . 0.0 108.628 179.506 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.561 ' CZ3' HG21 ' A' ' 15' ' ' THR . 6.0 m95 -57.44 106.72 0.36 Allowed 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.075 -1.016 . . . . 0.0 110.543 -179.327 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.0 92.39 4.53 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.328 -0.858 . . . . 0.0 109.559 179.717 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.51 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 2.0 tmt_? -72.76 126.53 30.13 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.118 -0.989 . . . . 0.0 109.729 179.838 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 8.0 t -90.17 140.42 27.31 Favored Pre-proline 0 N--CA 1.497 1.906 0 O-C-N 121.334 -0.854 . . . . 0.0 109.782 -179.888 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 6.2 Cg_exo -55.89 -36.04 94.97 Favored 'Trans proline' 0 C--N 1.32 -0.944 0 C-N-CA 122.582 2.188 . . . . 0.0 110.908 -179.563 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.4 ttt -51.45 -24.9 5.51 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.517 -0.739 . . . . 0.0 109.833 178.906 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . 0.441 ' HA2' ' CZ ' ' A' ' 20' ' ' ARG . . . 111.22 28.51 3.8 Favored Glycine 0 N--CA 1.496 2.673 0 N-CA-C 109.862 -1.295 . . . . 0.0 109.862 179.892 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 5.9 m-20 -133.48 104.76 12.09 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.21 -1.17 . . . . 0.0 110.419 -179.574 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.658 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.8 Cg_endo -64.0 117.88 4.86 Favored 'Trans proline' 0 C--N 1.313 -1.328 0 C-N-CA 122.127 1.885 . . . . 0.0 109.66 178.674 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.539 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.2 m -127.58 125.24 65.11 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.055 -1.028 . . . . 0.0 110.64 -179.625 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.448 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 8.0 p -51.53 131.61 29.49 Favored 'General case' 0 N--CA 1.485 1.292 0 N-CA-C 109.211 -0.663 . . . . 0.0 109.211 179.261 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.696 ' CB ' ' HB2' ' A' ' 17' ' ' LEU . 23.8 t-20 -39.63 -38.5 0.62 Allowed 'General case' 0 N--CA 1.506 2.374 0 O-C-N 121.633 -0.667 . . . . 0.0 111.34 -178.931 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.435 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . . . -51.23 -43.27 61.42 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.255 -0.903 . . . . 0.0 110.279 179.565 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.519 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 12.5 m -66.92 -44.6 80.31 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.632 -0.877 . . . . 0.0 108.632 179.126 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.54 -31.28 77.1 Favored Glycine 0 N--CA 1.493 2.465 0 N-CA-C 110.308 -1.117 . . . . 0.0 110.308 179.128 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.489 HD13 ' C7 ' ' C' ' 123' ' ' ' DT' . 48.5 mt -72.83 -67.61 0.55 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.331 -1.1 . . . . 0.0 110.047 -179.564 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.409 ' CE1' ' CD2' ' A' ' 38' ' ' HIS . 62.4 t80 -49.6 -35.01 19.47 Favored 'General case' 0 N--CA 1.502 2.146 0 O-C-N 121.399 -0.813 . . . . 0.0 109.638 179.958 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.537 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 13.1 t80 -61.5 -51.45 68.6 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.389 -0.819 . . . . 0.0 109.877 179.439 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.1 tttp -55.02 -26.34 36.5 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 120.28 -1.512 . . . . 0.0 110.567 179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.447 HD22 ' OP2' ' C' ' 122' ' ' ' DT' . 5.0 mp -72.96 -65.16 0.83 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.098 -1.001 . . . . 0.0 110.719 -179.308 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.492 ' HB2' HG22 ' A' ' 40' ' ' VAL . 26.2 m-70 -97.76 -27.19 14.44 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.325 -0.859 . . . . 0.0 110.213 -179.471 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.537 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 77.22 31.75 0.48 Allowed 'General case' 0 N--CA 1.502 2.16 0 CA-C-O 121.652 0.739 . . . . 0.0 110.779 179.876 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.492 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.6 m -121.33 175.7 4.73 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 O-C-N 120.911 -1.118 . . . . 0.0 109.48 178.564 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 8.1 p30 -60.82 167.92 2.57 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.164 -0.96 . . . . 0.0 110.395 -179.743 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.463 ' HD3' ' HD2' ' A' ' 43' ' ' PRO . 6.5 tpp180 -135.57 103.9 10.17 Favored Pre-proline 0 N--CA 1.491 1.614 0 O-C-N 121.04 -1.038 . . . . 0.0 109.462 179.907 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.463 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 6.1 Cg_exo -57.26 137.84 83.51 Favored 'Trans proline' 0 C--N 1.317 -1.088 0 C-N-CA 122.095 1.863 . . . . 0.0 110.229 179.657 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.554 ' HB2' ' HG3' ' A' ' 47' ' ' ARG . 0.9 OUTLIER -79.56 6.94 9.22 Favored 'General case' 0 N--CA 1.498 1.936 0 O-C-N 121.428 -0.795 . . . . 0.0 111.013 -179.608 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 2.7 p -56.97 -20.32 23.1 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.979 -1.075 . . . . 0.0 110.392 179.252 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.2 OUTLIER -82.55 -10.04 59.15 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.949 -1.095 . . . . 0.0 110.111 179.239 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.554 ' HG3' ' HB2' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -80.42 155.91 26.89 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 120.88 -1.138 . . . . 0.0 109.651 -179.971 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.433 ' HA ' ' HD2' ' A' ' 48' ' ' LYS . 5.5 mmmt -125.39 -156.86 0.75 Allowed 'General case' 0 N--CA 1.496 1.844 0 O-C-N 121.216 -0.928 . . . . 0.0 109.489 179.946 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.1 t70 -51.25 -53.08 38.83 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.174 -0.954 . . . . 0.0 109.719 179.801 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -139.91 -168.32 11.29 Favored Glycine 0 N--CA 1.496 2.635 0 N-CA-C 109.689 -1.364 . . . . 0.0 109.689 179.533 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.464 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.1 mt -53.75 125.36 7.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.403 -1.057 . . . . 0.0 110.063 179.92 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 6.4 mt-30 -66.32 142.69 57.56 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.409 -0.807 . . . . 0.0 109.427 179.322 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -150.39 164.22 36.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 120.991 -1.068 . . . . 0.0 109.771 179.578 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.468 ' HD3' " O3'" ' B' ' 112' ' ' ' DA' . 0.0 OUTLIER -151.79 -165.44 2.23 Favored 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 109.289 -0.634 . . . . 0.0 109.289 -179.59 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 1.3 t30 -54.27 116.27 2.52 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.052 -1.03 . . . . 0.0 108.712 179.107 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 1.5 ttm180 -45.05 135.64 5.29 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.585 -0.697 . . . . 0.0 110.607 -178.9 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 29.0 ttpt -62.16 145.47 53.36 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.43 -0.793 . . . . 0.0 109.915 -179.987 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 2.3 t -60.9 147.42 10.38 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.513 -0.742 . . . . 0.0 109.803 179.772 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.6 OUTLIER -56.3 152.56 10.93 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.488 -0.757 . . . . 0.0 110.226 -179.943 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 1.8 p . . . . . 0 N--CA 1.494 1.771 0 O-C-N 121.34 -0.85 . . . . 0.0 110.411 -179.451 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.597 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.614 2.14 0 O4'-C1'-N19 110.711 3.639 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.597 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.87 1 O4'-C1'-N19 112.025 5.282 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.616 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.217 1 O4'-C1'-N19 111.146 4.182 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.616 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.122 1 O4'-C1'-N19 111.23 4.288 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.558 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.443 1.798 0 O4'-C1'-N19 110.885 3.857 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.419 " O5'" H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.793 0 O4'-C1'-N19 110.995 3.994 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.816 1 O4'-C1'-N19 111.438 4.548 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.437 ' OP1' ' HD3' ' A' ' 54' ' ' ARG . . . . . . . . 0 P--O5' 1.611 1.844 0 O4'-C1'-N19 110.473 3.342 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.669 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.963 1 O4'-C1'-N19 111.336 4.42 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.669 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.649 1 O4'-C1'-N19 111.869 5.087 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.544 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.559 1 O4'-C1'-N19 111.411 4.513 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.513 " O5'" H2'' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.185 0 O4'-C1'-N19 110.511 3.389 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.483 ' OP2' ' HB2' ' A' ' 30' ' ' ALA . . . . . . . . 0 C5'--C4' 1.534 2.863 0 O4'-C1'-N19 110.468 3.334 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.641 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.471 1 O4'-C1'-N19 112.566 5.958 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.506 " H2'" ' C5 ' ' C' ' 127' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.767 0 O4'-C1'-N19 110.78 3.725 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.506 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.471 0 O4'-C1'-N19 110.896 3.871 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 N--CA 1.495 1.811 0 N-CA-C 109.603 -0.517 . . . . 0.0 109.603 . . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -91.34 43.77 1.16 Allowed 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.027 -1.046 . . . . 0.0 109.617 179.893 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.3 153.76 14.75 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.36 -0.838 . . . . 0.0 109.645 179.96 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 106.99 -40.37 2.54 Favored Glycine 0 N--CA 1.491 2.351 0 N-CA-C 108.239 -1.944 . . . . 0.0 108.239 -178.539 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.531 HG23 ' CB ' ' A' ' 26' ' ' PRO . 54.4 m -80.63 89.21 5.7 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.381 -1.07 . . . . 0.0 109.471 179.043 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 33.1 m -101.59 131.26 49.81 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.732 0 N-CA-C 107.908 -1.145 . . . . 0.0 107.908 178.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.522 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 33.6 t -47.63 114.98 1.0 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.544 -0.722 . . . . 0.0 111.0 -179.122 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 25.1 m -59.69 -13.48 10.04 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.087 -1.008 . . . . 0.0 110.323 179.29 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 1.5 m-80 -102.51 -32.06 10.12 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 120.822 -1.174 . . . . 0.0 110.931 -179.814 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.479 ' HB2' ' HA ' ' A' ' 44' ' ' LEU . 13.0 p -140.63 23.34 2.3 Favored 'General case' 0 N--CA 1.5 2.057 0 O-C-N 120.602 -1.312 . . . . 0.0 111.581 -179.532 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 3.0 pt20 38.75 29.45 0.03 OUTLIER 'General case' 0 N--CA 1.509 2.495 0 N-CA-C 113.017 0.747 . . . . 0.0 113.017 178.675 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.523 HG23 HG22 ' A' ' 15' ' ' THR . 15.3 t -86.69 132.7 33.8 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 120.669 -1.269 . . . . 0.0 109.403 178.981 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 1.4 p -89.31 -28.83 19.6 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.565 -0.709 . . . . 0.0 109.34 179.745 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.402 ' HB ' HG13 ' A' ' 51' ' ' ILE . 23.2 p -90.18 108.36 19.7 Favored 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 108.281 -1.007 . . . . 0.0 108.281 178.839 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.743 ' C ' HD11 ' A' ' 51' ' ' ILE . 14.6 p -127.08 144.36 51.05 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.161 -0.962 . . . . 0.0 109.937 -179.527 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.641 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 30.9 p -65.96 -36.27 82.87 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 107.937 -1.134 . . . . 0.0 107.937 179.122 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.533 HD22 ' N7 ' ' B' ' 106' ' ' ' DA' . 12.9 mt -149.08 120.31 7.81 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 108.843 -0.799 . . . . 0.0 108.843 179.055 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.571 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.6 m95 -73.6 95.32 2.28 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.454 -0.779 . . . . 0.0 109.808 -179.452 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.16 77.11 2.3 Favored 'General case' 0 C--N 1.304 -1.396 0 O-C-N 121.403 -0.811 . . . . 0.0 108.82 179.629 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.416 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 1.5 mmt180 -61.19 95.3 0.04 OUTLIER 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.454 -0.779 . . . . 0.0 109.059 -179.795 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -62.2 144.31 94.69 Favored Pre-proline 0 N--CA 1.496 1.871 0 O-C-N 121.394 -0.816 . . . . 0.0 109.967 -179.162 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -58.69 -20.91 53.18 Favored 'Trans proline' 0 C--N 1.32 -0.973 0 C-N-CA 122.47 2.113 . . . . 0.0 110.672 179.85 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -77.8 0.04 25.31 Favored 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.18 -0.95 . . . . 0.0 109.9 178.978 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 86.66 32.57 15.15 Favored Glycine 0 N--CA 1.494 2.516 0 N-CA-C 109.433 -1.467 . . . . 0.0 109.433 -179.48 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 36.1 m-20 -129.51 96.59 26.93 Favored Pre-proline 0 N--CA 1.493 1.719 0 O-C-N 121.443 -1.034 . . . . 0.0 110.553 -179.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' CB ' HG23 ' A' ' 5' ' ' THR . 2.6 Cg_endo -64.16 111.38 1.58 Allowed 'Trans proline' 0 C--N 1.314 -1.244 0 C-N-CA 122.223 1.949 . . . . 0.0 110.172 178.89 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.494 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -121.45 124.77 72.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.418 -0.801 . . . . 0.0 110.078 179.896 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.444 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 5.0 p -48.46 135.7 13.76 Favored 'General case' 0 N--CA 1.486 1.336 0 O-C-N 121.589 -0.694 . . . . 0.0 109.886 179.663 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.515 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 4.6 t-20 -37.04 -44.51 0.53 Allowed 'General case' 0 N--CA 1.506 2.345 0 O-C-N 121.62 -0.675 . . . . 0.0 112.2 -178.608 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.483 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -49.66 -51.92 34.64 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.421 -0.8 . . . . 0.0 110.235 -179.703 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.426 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 63.6 m -63.63 -39.54 94.6 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.301 -0.875 . . . . 0.0 109.537 179.665 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -61.0 -36.13 91.8 Favored Glycine 0 N--CA 1.498 2.806 0 N-CA-C 110.306 -1.118 . . . . 0.0 110.306 179.663 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.449 HD11 ' H62' ' C' ' 124' ' ' ' DA' . 85.7 mt -73.21 -66.55 0.67 Allowed 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.395 -1.062 . . . . 0.0 109.985 -179.718 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.826 ' HA ' HD22 ' A' ' 37' ' ' LEU . 8.3 t80 -49.11 -40.44 32.18 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 121.235 -0.916 . . . . 0.0 109.114 179.628 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.465 ' O ' ' N ' ' A' ' 39' ' ' GLN . 38.2 t80 -51.0 -48.63 61.3 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.633 -0.667 . . . . 0.0 109.405 179.486 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.6 OUTLIER -66.39 -38.46 87.57 Favored 'General case' 0 N--CA 1.503 2.206 0 O-C-N 121.065 -1.022 . . . . 0.0 110.248 179.617 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.826 HD22 ' HA ' ' A' ' 34' ' ' TYR . 5.1 mp -41.08 -51.37 3.37 Favored 'General case' 0 N--CA 1.506 2.34 0 O-C-N 121.507 -0.745 . . . . 0.0 110.197 -179.577 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.664 ' HB2' HG22 ' A' ' 40' ' ' VAL . 4.1 m-70 -127.91 17.73 6.74 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 121.27 -0.893 . . . . 0.0 109.555 179.298 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.465 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.3 OUTLIER 47.22 46.77 16.66 Favored 'General case' 0 N--CA 1.501 2.108 0 CA-C-O 121.817 0.817 . . . . 0.0 109.597 -178.989 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.664 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.8 m -133.6 164.36 35.05 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 O-C-N 121.41 -0.806 . . . . 0.0 109.963 -179.779 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.2 p-10 -77.97 163.06 26.3 Favored 'General case' 0 N--CA 1.496 1.835 0 O-C-N 121.431 -0.793 . . . . 0.0 110.351 179.844 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.614 ' HB2' ' CD1' ' A' ' 34' ' ' TYR . 4.4 tpt180 -130.14 121.02 19.44 Favored Pre-proline 0 N--CA 1.495 1.814 0 O-C-N 121.222 -0.924 . . . . 0.0 109.222 179.289 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -64.02 147.0 91.82 Favored 'Trans proline' 0 C--N 1.317 -1.123 0 C-N-CA 121.925 1.75 . . . . 0.0 110.432 179.807 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.479 ' HA ' ' HB2' ' A' ' 10' ' ' CYS . 1.7 pt? -63.08 -10.99 16.62 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.442 -0.786 . . . . 0.0 110.921 179.588 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 4.9 t -48.73 -31.07 6.32 Favored 'General case' 0 N--CA 1.507 2.391 0 O-C-N 121.208 -0.933 . . . . 0.0 110.824 179.751 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.3 ttt -80.68 -39.66 26.83 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.162 -0.961 . . . . 0.0 109.426 179.656 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.486 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.8 OUTLIER -61.8 129.21 39.92 Favored 'General case' 0 N--CA 1.492 1.636 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 179.111 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -99.16 -149.56 0.36 Allowed 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.281 -0.887 . . . . 0.0 109.685 -179.427 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.1 m-20 -50.63 -81.9 0.01 OUTLIER 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.433 -0.792 . . . . 0.0 110.899 -179.182 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -123.02 -168.45 13.1 Favored Glycine 0 N--CA 1.495 2.587 0 N-CA-C 110.025 -1.23 . . . . 0.0 110.025 -179.752 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.743 HD11 ' C ' ' A' ' 15' ' ' THR . 13.9 mt -48.05 129.53 4.54 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.606 -0.938 . . . . 0.0 110.455 -179.772 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 2.0 mt-30 -76.36 78.68 3.11 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.3 -0.875 . . . . 0.0 109.861 179.773 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -79.47 161.15 26.25 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.401 -0.812 . . . . 0.0 109.638 179.591 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.437 ' HD3' ' OP1' ' B' ' 113' ' ' ' DC' . 0.4 OUTLIER -150.77 -153.63 0.5 Allowed 'General case' 0 N--CA 1.494 1.731 0 O-C-N 121.61 -0.681 . . . . 0.0 109.767 -179.501 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.6 OUTLIER -74.97 128.94 36.75 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.06 -1.025 . . . . 0.0 108.724 179.031 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -46.59 133.64 10.1 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.586 -0.696 . . . . 0.0 110.643 -179.349 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 10.1 ttpt -60.66 140.62 57.4 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.366 -0.834 . . . . 0.0 109.497 179.801 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.461 HG13 ' O ' ' A' ' 58' ' ' VAL . 10.3 p -65.06 122.5 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 179.095 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -57.16 109.2 0.62 Allowed 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.16 -0.962 . . . . 0.0 108.808 -179.822 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 6.1 t . . . . . 0 N--CA 1.496 1.852 0 O-C-N 121.336 -0.852 . . . . 0.0 109.997 -179.087 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.564 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.672 0 O4'-C1'-N19 110.532 3.416 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.564 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.524 1.564 1 O4'-C1'-N19 111.908 5.135 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.663 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.004 1 O4'-C1'-N19 111.089 4.112 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.663 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.704 0 O4'-C1'-N19 110.971 3.964 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.486 H2'' ' C8 ' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.752 0 O4'-C1'-N19 110.675 3.594 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.486 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.444 1.827 0 O4'-C1'-N19 110.858 3.822 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.452 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.807 1 O4'-C1'-N19 111.468 4.585 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.452 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.443 1.737 0 C3'-C2'-C1' 107.26 3.257 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.689 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.833 0 O4'-C1'-N19 110.887 3.859 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.689 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.532 2.572 1 O4'-C1'-N19 111.957 5.196 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.603 ' H71' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.376 0 O4'-C1'-N19 110.943 3.929 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.545 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.537 0 O4'-C1'-N19 110.61 3.513 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.601 " H2'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.529 2.235 1 O4'-C1'-N19 111.346 4.433 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.596 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.472 1 O4'-C1'-N19 112.059 5.324 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.475 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.728 0 O4'-C1'-N19 110.868 3.835 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.409 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.258 1 O4'-C1'-N19 111.364 4.455 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 10.1 tttm . . . . . 0 N--CA 1.498 1.931 0 CA-C-O 121.243 0.544 . . . . 0.0 110.008 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 4.3 tpm_? -64.11 -25.18 67.98 Favored 'General case' 0 N--CA 1.499 2.001 0 O-C-N 121.001 -1.062 . . . . 0.0 109.155 179.253 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -56.1 129.44 39.98 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.447 -0.783 . . . . 0.0 108.982 178.908 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.53 -33.54 3.58 Favored Glycine 0 N--CA 1.493 2.475 0 N-CA-C 108.991 -1.644 . . . . 0.0 108.991 -179.058 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.594 HG23 ' HB2' ' A' ' 26' ' ' PRO . 27.2 m -62.77 90.75 0.04 OUTLIER 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.32 -1.106 . . . . 0.0 108.787 178.95 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.409 HG22 ' H ' ' A' ' 6' ' ' VAL . 9.5 m -84.96 112.66 22.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.537 0 O-C-N 121.069 -1.019 . . . . 0.0 108.379 -179.975 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.505 ' O ' ' N ' ' A' ' 11' ' ' GLN . 44.8 t -47.45 113.7 0.74 Allowed 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.428 -0.795 . . . . 0.0 109.917 -179.157 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 62.0 m -66.68 -12.56 58.86 Favored 'General case' 0 N--CA 1.5 2.037 0 O-C-N 121.021 -1.049 . . . . 0.0 111.001 -179.247 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.461 ' ND2' HG11 ' A' ' 27' ' ' VAL . 0.9 OUTLIER -89.62 -31.31 17.61 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 120.84 -1.162 . . . . 0.0 110.228 179.879 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.47 ' SG ' HG22 ' A' ' 12' ' ' THR . 16.8 p -140.46 17.4 2.38 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.887 -1.133 . . . . 0.0 111.057 179.455 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.505 ' N ' ' O ' ' A' ' 7' ' ' CYS . 11.5 mt-30 51.49 21.2 1.19 Allowed 'General case' 0 N--CA 1.502 2.131 0 O-C-N 120.989 -1.069 . . . . 0.0 111.801 178.949 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.47 HG22 ' SG ' ' A' ' 10' ' ' CYS . 6.3 t -87.61 136.47 32.93 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.681 -1.262 . . . . 0.0 110.564 -179.724 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.0 OUTLIER -90.93 -27.12 18.93 Favored 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 179.302 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.517 HG21 ' HA2' ' A' ' 50' ' ' GLY . 18.6 p -90.06 127.09 35.99 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.416 -0.802 . . . . 0.0 109.537 179.527 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.696 HG21 ' CH2' ' A' ' 18' ' ' TRP . 10.3 p -145.69 144.09 30.18 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.409 -0.807 . . . . 0.0 110.225 -179.558 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.601 HG21 " H2'" ' C' ' 124' ' ' ' DA' . 20.2 p -72.63 -28.59 62.85 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.329 -0.857 . . . . 0.0 109.098 179.139 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.587 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.9 mt -152.71 117.17 4.98 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 108.57 -0.9 . . . . 0.0 108.57 179.173 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.696 ' CH2' HG21 ' A' ' 15' ' ' THR . 8.0 m95 -73.82 108.81 6.87 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.183 -0.948 . . . . 0.0 110.09 -179.02 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -99.3 94.47 6.48 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.133 -0.979 . . . . 0.0 109.452 179.777 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.436 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 5.3 tpp180 -66.6 102.71 0.95 Allowed 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.137 -0.977 . . . . 0.0 108.364 179.364 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.427 ' HB2' ' O ' ' A' ' 25' ' ' ASP . 0.4 OUTLIER -56.36 146.74 51.62 Favored Pre-proline 0 N--CA 1.5 2.052 0 O-C-N 121.388 -0.82 . . . . 0.0 110.209 -178.718 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.4 Cg_exo -52.92 -43.91 52.82 Favored 'Trans proline' 0 C--N 1.319 -0.995 0 C-N-CA 122.702 2.268 . . . . 0.0 111.07 -179.05 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 15.6 ttp -57.59 -23.49 51.11 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.414 -0.804 . . . . 0.0 109.717 179.137 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.35 38.22 1.38 Allowed Glycine 0 N--CA 1.496 2.665 0 N-CA-C 110.028 -1.229 . . . . 0.0 110.028 179.641 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . 0.427 ' O ' ' HB2' ' A' ' 21' ' ' SER . 60.5 m-20 -128.3 110.09 19.54 Favored Pre-proline 0 N--CA 1.496 1.839 0 O-C-N 121.1 -1.236 . . . . 0.0 110.491 -179.841 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.594 ' HB2' HG23 ' A' ' 5' ' ' THR . 3.5 Cg_exo -62.92 109.86 1.01 Allowed 'Trans proline' 0 C--N 1.313 -1.313 0 C-N-CA 122.011 1.807 . . . . 0.0 110.062 178.627 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.461 HG11 ' ND2' ' A' ' 9' ' ' ASN . 2.1 m -121.56 131.38 73.21 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.912 0 O-C-N 121.163 -0.961 . . . . 0.0 110.407 179.923 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.471 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 7.8 p -55.03 132.55 47.4 Favored 'General case' 0 C--N 1.306 -1.32 0 O-C-N 121.663 -0.648 . . . . 0.0 109.305 179.556 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.587 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 16.7 t-20 -35.58 -46.09 0.39 Allowed 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.87 -0.519 . . . . 0.0 112.162 -178.313 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.497 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -50.77 -45.46 59.0 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.347 -0.845 . . . . 0.0 110.206 -179.688 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.432 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 19.4 m -65.53 -39.34 91.68 Favored 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.177 -0.952 . . . . 0.0 109.001 179.263 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.22 -43.39 95.45 Favored Glycine 0 N--CA 1.497 2.743 0 N-CA-C 110.404 -1.078 . . . . 0.0 110.404 -179.849 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.446 ' O ' HD13 ' A' ' 37' ' ' LEU . 46.6 mt -75.69 -57.46 3.87 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.454 -1.027 . . . . 0.0 109.698 -179.831 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.631 ' HA ' HD22 ' A' ' 37' ' ' LEU . 26.9 t80 -51.84 -38.56 56.39 Favored 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.512 -0.742 . . . . 0.0 109.046 179.475 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.478 ' O ' ' N ' ' A' ' 39' ' ' GLN . 44.8 t80 -56.35 -45.56 80.38 Favored 'General case' 0 N--CA 1.491 1.622 0 N-CA-C 108.898 -0.778 . . . . 0.0 108.898 178.705 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.04 -39.4 93.29 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.066 -1.021 . . . . 0.0 109.899 179.319 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.631 HD22 ' HA ' ' A' ' 34' ' ' TYR . 5.8 mp -44.88 -59.12 2.71 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.562 -0.711 . . . . 0.0 110.128 -179.466 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.527 ' CB ' HG22 ' A' ' 40' ' ' VAL . 87.9 m-70 -104.14 4.64 34.34 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.45 -0.781 . . . . 0.0 109.415 178.828 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.478 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 49.7 33.83 6.62 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 121.565 -0.709 . . . . 0.0 110.027 -178.702 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.527 HG22 ' CB ' ' A' ' 38' ' ' HIS . 11.1 m -140.17 163.79 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.105 0 O-C-N 121.463 -0.773 . . . . 0.0 110.018 -179.612 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 4.2 p30 -82.17 140.97 33.44 Favored 'General case' 0 N--CA 1.492 1.627 0 N-CA-C 108.421 -0.955 . . . . 0.0 108.421 178.335 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.551 ' HG3' ' CE2' ' A' ' 34' ' ' TYR . 2.3 mmm180 -127.99 150.39 73.5 Favored Pre-proline 0 N--CA 1.493 1.693 0 O-C-N 121.014 -1.054 . . . . 0.0 110.09 -179.493 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 6.3 Cg_exo -57.09 151.68 49.07 Favored 'Trans proline' 0 C--N 1.315 -1.211 0 C-N-CA 123.005 2.47 . . . . 0.0 111.814 -179.074 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.443 ' HB2' ' HD3' ' A' ' 47' ' ' ARG . 1.0 OUTLIER -71.57 10.18 0.7 Allowed 'General case' 0 N--CA 1.499 1.991 0 O-C-N 121.594 -0.691 . . . . 0.0 111.568 179.793 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.9 OUTLIER -55.02 -32.41 61.82 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.611 -1.305 . . . . 0.0 110.18 179.54 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -86.07 -12.78 49.24 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.399 -0.813 . . . . 0.0 110.346 179.515 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.443 ' HD3' ' HB2' ' A' ' 44' ' ' LEU . 0.2 OUTLIER -58.71 162.11 4.22 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.903 -1.123 . . . . 0.0 109.965 179.822 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -124.28 149.76 46.15 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.458 -0.776 . . . . 0.0 109.456 178.895 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 35.6 t70 -63.81 -35.01 79.21 Favored 'General case' 0 N--CA 1.5 2.056 0 O-C-N 121.493 -0.754 . . . . 0.0 110.175 -179.862 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . 0.517 ' HA2' HG21 ' A' ' 14' ' ' THR . . . -134.53 157.0 22.73 Favored Glycine 0 N--CA 1.496 2.676 0 N-CA-C 108.995 -1.642 . . . . 0.0 108.995 179.318 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.552 HG23 HG22 ' A' ' 16' ' ' THR . 4.9 mt -53.31 119.5 1.42 Allowed 'Isoleucine or valine' 0 N--CA 1.495 1.779 0 O-C-N 121.157 -1.202 . . . . 0.0 109.987 -179.618 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.504 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -75.6 167.28 22.19 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.634 -0.666 . . . . 0.0 109.206 179.755 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.484 ' N ' ' HG3' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -154.98 160.67 41.27 Favored 'General case' 0 N--CA 1.494 1.759 0 N-CA-C 108.775 -0.824 . . . . 0.0 108.775 178.571 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.47 -161.66 1.39 Allowed 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 108.962 -0.755 . . . . 0.0 108.962 -179.617 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.1 OUTLIER -62.37 94.46 0.06 Allowed 'General case' 0 N--CA 1.494 1.77 0 O-C-N 120.825 -1.172 . . . . 0.0 108.924 179.302 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.411 ' HB3' " H4'" ' C' ' 125' ' ' ' DT' . 5.1 ptp180 -54.49 143.84 22.95 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.483 -0.761 . . . . 0.0 109.97 -179.502 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 16.0 ttpp -61.65 123.33 17.63 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.358 -0.839 . . . . 0.0 109.152 179.797 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 61.9 t -53.14 153.15 0.92 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.386 -0.821 . . . . 0.0 110.539 -179.231 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.3 m -64.88 169.31 5.31 Favored 'General case' 0 N--CA 1.494 1.762 0 CA-C-O 121.396 0.617 . . . . 0.0 110.324 -179.97 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.6 t . . . . . 0 N--CA 1.495 1.783 0 O-C-N 121.264 -0.897 . . . . 0.0 109.858 179.761 . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.527 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.688 0 O4'-C1'-N19 110.57 3.462 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.55 ' N7 ' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 O4'--C1' 1.441 1.582 1 O4'-C1'-N19 111.535 4.668 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.669 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.467 1 O4'-C1'-N19 111.424 4.529 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.669 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.531 2.544 1 O4'-C1'-N19 111.157 4.197 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.537 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.613 1.996 0 O4'-C1'-N19 110.697 3.621 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.528 2.087 0 O4'-C1'-N19 110.926 3.908 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.443 ' C6 ' ' N4 ' ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.524 1.614 1 O4'-C1'-N19 111.454 4.568 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.443 ' N4 ' ' C6 ' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.61 1.704 0 O4'-C1'-N19 110.7 3.625 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.654 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.777 1 O4'-C1'-N19 111.166 4.208 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.654 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.527 1 O4'-C1'-N19 111.839 5.048 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.577 ' H71' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 2.035 1 O4'-C1'-N19 111.019 4.024 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.483 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.942 0 O4'-C1'-N19 110.544 3.429 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.543 ' N6 ' ' N6 ' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.529 2.295 0 O4'-C1'-N19 110.449 3.311 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.605 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.531 2.463 1 O4'-C1'-N19 112.453 5.816 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.5 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.532 2.611 0 O4'-C1'-N19 110.874 3.842 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.476 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.53 2.334 0 O4'-C1'-N19 110.923 3.904 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.495 1.814 0 N-CA-C 109.487 -0.56 . . . . 0.0 109.487 . . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.3 OUTLIER -81.26 -43.37 19.29 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.215 -0.928 . . . . 0.0 108.8 179.218 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.86 104.46 1.7 Allowed 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.536 -0.728 . . . . 0.0 109.709 179.683 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 116.91 -18.23 12.68 Favored Glycine 0 N--CA 1.495 2.596 0 N-CA-C 110.423 -1.071 . . . . 0.0 110.423 -179.846 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.549 HG22 ' O ' ' A' ' 5' ' ' THR . 15.2 m -76.46 85.57 3.19 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 120.82 -1.4 . . . . 0.0 110.314 -179.789 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 12.4 m -85.77 120.37 35.7 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.651 0 N-CA-C 107.08 -1.452 . . . . 0.0 107.08 178.18 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.474 ' HA ' ' O ' ' A' ' 26' ' ' PRO . 51.5 t -45.46 111.55 0.35 Allowed 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.206 -0.934 . . . . 0.0 110.202 -178.327 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 71.8 m -59.71 -14.31 13.64 Favored 'General case' 0 N--CA 1.501 2.084 0 O-C-N 121.171 -0.956 . . . . 0.0 111.437 -179.212 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.541 ' OD1' ' HD2' ' A' ' 42' ' ' ARG . 0.9 OUTLIER -95.39 -30.83 13.7 Favored 'General case' 0 N--CA 1.5 2.062 0 O-C-N 120.634 -1.291 . . . . 0.0 110.734 -179.572 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.486 ' SG ' ' HD3' ' A' ' 47' ' ' ARG . 18.4 p -141.26 28.37 1.87 Allowed 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.897 -1.127 . . . . 0.0 110.492 179.289 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.576 HE22 HD22 ' A' ' 44' ' ' LEU . 5.5 pm0 34.22 30.19 0.01 OUTLIER 'General case' 0 N--CA 1.514 2.728 0 N-CA-C 112.955 0.724 . . . . 0.0 112.955 179.781 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.453 ' H ' ' HB3' ' A' ' 7' ' ' CYS . 5.1 t -90.88 132.56 35.84 Favored 'General case' 0 N--CA 1.491 1.581 0 O-C-N 120.747 -1.22 . . . . 0.0 109.844 179.479 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 2.2 p -90.29 -28.6 18.67 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.237 -0.914 . . . . 0.0 109.107 179.379 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.7 p -89.86 111.04 21.95 Favored 'General case' 0 N--CA 1.498 1.928 0 O-C-N 121.431 -0.793 . . . . 0.0 109.479 179.5 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.549 HG21 ' CH2' ' A' ' 18' ' ' TRP . 9.5 p -130.97 166.52 20.8 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.332 -0.855 . . . . 0.0 110.205 -179.712 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.605 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 16.2 p -89.41 -40.57 12.63 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 179.353 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.553 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 14.3 mt -141.89 112.56 7.22 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 109.094 -0.706 . . . . 0.0 109.094 179.321 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.549 ' CH2' HG21 ' A' ' 15' ' ' THR . 7.0 m95 -69.67 88.72 0.53 Allowed 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.304 -0.873 . . . . 0.0 109.608 -179.389 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.78 84.85 7.2 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.61 -0.682 . . . . 0.0 109.424 -179.913 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.469 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 9.3 tpp180 -62.17 120.83 11.67 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.113 -0.992 . . . . 0.0 109.213 179.726 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -77.59 144.01 68.84 Favored Pre-proline 0 N--CA 1.498 1.932 0 O-C-N 121.298 -0.876 . . . . 0.0 110.187 -179.439 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -56.45 -42.49 65.09 Favored 'Trans proline' 0 C--N 1.319 -1.014 0 C-N-CA 122.737 2.291 . . . . 0.0 111.197 -179.294 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -57.79 -21.03 39.62 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.299 -0.875 . . . . 0.0 110.061 179.486 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.63 35.92 1.65 Allowed Glycine 0 N--CA 1.497 2.759 0 N-CA-C 110.015 -1.234 . . . . 0.0 110.015 179.814 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 69.2 m-20 -127.03 102.75 24.13 Favored Pre-proline 0 N--CA 1.494 1.762 0 O-C-N 121.207 -1.172 . . . . 0.0 110.142 -179.796 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.494 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.6 Cg_endo -64.02 98.56 0.26 Allowed 'Trans proline' 0 C--N 1.312 -1.364 0 C-N-CA 122.162 1.908 . . . . 0.0 109.604 178.793 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.474 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.0 m -109.74 153.94 11.37 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 CA-C-O 122.348 1.07 . . . . 0.0 111.114 -179.622 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.467 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 15.3 p -81.48 138.72 35.47 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.727 -0.842 . . . . 0.0 108.727 179.433 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.553 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 4.7 t-20 -37.96 -37.24 0.24 Allowed 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.695 -0.628 . . . . 0.0 111.971 -178.799 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.44 ' HB2' ' OP2' ' C' ' 124' ' ' ' DA' . . . -64.39 -42.77 95.94 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.09 -1.006 . . . . 0.0 111.695 -179.329 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.508 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 4.9 m -61.52 -40.67 95.47 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.212 -0.93 . . . . 0.0 109.088 -179.934 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -67.4 -49.02 54.53 Favored Glycine 0 N--CA 1.493 2.472 0 N-CA-C 109.869 -1.292 . . . . 0.0 109.869 179.855 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.427 ' O ' HD13 ' A' ' 37' ' ' LEU . 94.8 mt -60.58 -58.41 8.6 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.638 -0.919 . . . . 0.0 109.63 179.975 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.624 ' CE1' ' HD2' ' A' ' 43' ' ' PRO . 20.4 t80 -54.51 -43.84 72.21 Favored 'General case' 0 N--CA 1.497 1.885 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 179.543 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.507 ' CD2' ' O ' ' A' ' 40' ' ' VAL . 20.0 t80 -51.91 -46.57 64.66 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.508 -0.745 . . . . 0.0 109.073 179.27 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.8 tttt -63.34 -41.92 98.9 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 121.214 -0.929 . . . . 0.0 110.152 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.568 HD22 ' HA ' ' A' ' 34' ' ' TYR . 3.9 mp -45.36 -59.28 2.76 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 121.329 -0.857 . . . . 0.0 110.427 -179.439 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.516 ' CB ' HG22 ' A' ' 40' ' ' VAL . 53.4 m-70 -102.61 6.42 39.71 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.374 -0.829 . . . . 0.0 109.853 179.565 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.448 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.6 OUTLIER 46.7 31.89 1.55 Allowed 'General case' 0 N--CA 1.507 2.422 0 O-C-N 121.51 -0.744 . . . . 0.0 110.299 -179.212 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.516 HG22 ' CB ' ' A' ' 38' ' ' HIS . 3.9 m -134.61 -161.47 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.274 0 O-C-N 121.476 -0.765 . . . . 0.0 109.048 179.652 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 23.5 p30 -59.1 -175.01 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.949 0 O-C-N 120.996 -1.065 . . . . 0.0 110.596 -179.883 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.541 ' HD2' ' OD1' ' A' ' 9' ' ' ASN . 0.0 OUTLIER -141.1 102.91 6.17 Favored Pre-proline 0 N--CA 1.491 1.589 0 O-C-N 121.106 -0.996 . . . . 0.0 109.969 -179.189 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.624 ' HD2' ' CE1' ' A' ' 34' ' ' TYR . 3.9 Cg_exo -60.62 126.05 18.87 Favored 'Trans proline' 0 C--N 1.315 -1.186 0 C-N-CA 121.991 1.794 . . . . 0.0 110.08 179.753 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.576 HD22 HE22 ' A' ' 11' ' ' GLN . 1.3 pp -85.05 16.43 3.47 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.385 -0.822 . . . . 0.0 110.935 -179.836 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 52.7 p -68.45 -5.65 20.46 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.02 -1.05 . . . . 0.0 111.07 -179.917 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . 0.422 ' HE1' " H4'" ' C' ' 122' ' ' ' DT' . 65.9 mtp -94.23 -26.79 16.49 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 120.883 -1.136 . . . . 0.0 110.144 179.948 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.486 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -65.25 154.4 38.25 Favored 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.215 -0.928 . . . . 0.0 110.264 179.994 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.36 -158.61 0.9 Allowed 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 109.002 -0.74 . . . . 0.0 109.002 179.921 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 14.3 t70 -60.08 -39.1 84.9 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.288 -0.882 . . . . 0.0 109.693 179.384 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.07 -175.33 14.13 Favored Glycine 0 N--CA 1.5 2.931 0 N-CA-C 110.19 -1.164 . . . . 0.0 110.19 179.513 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.496 HG21 HG22 ' A' ' 16' ' ' THR . 3.8 mt -62.31 137.12 24.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 O-C-N 121.286 -1.126 . . . . 0.0 108.965 179.453 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -65.66 79.87 0.07 Allowed 'General case' 0 N--CA 1.499 2.02 0 O-C-N 121.22 -0.925 . . . . 0.0 111.047 -178.638 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.6 OUTLIER -103.06 159.54 15.43 Favored 'General case' 0 N--CA 1.496 1.839 0 O-C-N 121.137 -0.977 . . . . 0.0 110.4 179.564 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.64 -159.11 0.99 Allowed 'General case' 0 N--CA 1.491 1.61 0 N-CA-C 108.482 -0.933 . . . . 0.0 108.482 179.865 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 99.1 m-20 -52.56 103.15 0.06 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.833 -1.167 . . . . 0.0 109.159 179.208 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 16.5 ttm180 -50.74 140.8 14.07 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.369 -0.832 . . . . 0.0 110.339 -178.834 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -74.39 130.18 39.16 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.475 -0.766 . . . . 0.0 109.281 179.077 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.9 OUTLIER -60.41 151.25 6.06 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.043 0 O-C-N 121.453 -0.78 . . . . 0.0 110.077 -179.825 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -51.6 141.82 15.53 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.475 -0.765 . . . . 0.0 110.011 179.796 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.498 1.968 0 O-C-N 121.378 -0.826 . . . . 0.0 110.655 -179.515 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.542 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 O4'--C1' 1.442 1.72 0 O4'-C1'-N19 110.557 3.447 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.542 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.081 1 O4'-C1'-N19 111.932 5.165 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.599 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.527 1.959 0 O4'-C1'-N19 110.867 3.834 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.599 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.726 1 O4'-C1'-N19 111.266 4.333 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.535 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.922 0 O4'-C1'-N19 110.797 3.746 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.527 1.965 0 O4'-C1'-N19 110.787 3.734 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.442 1.723 1 O4'-C1'-N19 111.094 4.117 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.832 0 O4'-C1'-N19 110.449 3.311 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.571 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.442 1.725 0 O4'-C1'-N19 110.838 3.798 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.571 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.531 2.456 1 O4'-C1'-N19 111.784 4.98 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.504 H2'' " O5'" ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.53 2.412 0 O4'-C1'-N19 110.997 3.996 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.522 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.067 0 O4'-C1'-N19 110.655 3.569 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.523 " H2'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.53 2.325 0 O4'-C1'-N19 110.519 3.399 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.558 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.526 1.894 1 O4'-C1'-N19 112.383 5.728 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.517 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.763 0 O4'-C1'-N19 110.553 3.441 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.499 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.808 0 O4'-C1'-N19 110.922 3.902 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 15.6 mtmt . . . . . 0 N--CA 1.5 2.048 0 CA-C-O 120.822 0.344 . . . . 0.0 110.616 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 29.1 mmt180 -78.19 -3.38 42.31 Favored 'General case' 0 N--CA 1.499 2.002 0 O-C-N 120.974 -1.079 . . . . 0.0 110.767 -179.82 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -65.84 109.7 2.58 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.146 -0.971 . . . . 0.0 109.384 179.315 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 125.25 -26.52 5.51 Favored Glycine 0 N--CA 1.497 2.747 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 -179.399 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.478 HG23 ' CB ' ' A' ' 26' ' ' PRO . 70.8 m -68.4 92.64 0.44 Allowed 'General case' 0 N--CA 1.494 1.728 0 O-C-N 121.302 -1.117 . . . . 0.0 109.089 179.295 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 17.2 m -90.91 138.26 19.96 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.676 0 O-C-N 121.283 -0.886 . . . . 0.0 108.722 179.839 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.748 ' HB2' HG22 ' A' ' 12' ' ' THR . 24.6 t -62.42 118.08 7.02 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.146 -0.971 . . . . 0.0 110.973 -179.35 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 20.4 m -60.4 -15.47 26.52 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.387 -0.821 . . . . 0.0 110.295 178.85 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.673 ' OD1' HG11 ' A' ' 27' ' ' VAL . 9.0 m120 -102.82 -30.4 10.87 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.065 -1.022 . . . . 0.0 110.852 -179.764 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.493 ' SG ' ' HG3' ' A' ' 47' ' ' ARG . 12.8 p -142.66 23.43 1.94 Allowed 'General case' 0 N--CA 1.501 2.113 0 O-C-N 120.672 -1.268 . . . . 0.0 111.909 -179.306 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 1.7 mt-30 38.25 37.5 0.16 Allowed 'General case' 0 N--CA 1.511 2.597 0 N-CA-C 113.079 0.77 . . . . 0.0 113.079 178.483 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.748 HG22 ' HB2' ' A' ' 7' ' ' CYS . 5.3 t -88.14 135.13 33.57 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 120.527 -1.358 . . . . 0.0 108.694 178.333 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 6.4 p -90.44 -10.79 42.45 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.159 -0.963 . . . . 0.0 109.736 179.922 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.422 ' HB ' HG13 ' A' ' 51' ' ' ILE . 34.7 p -121.26 132.53 54.86 Favored 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.217 -0.927 . . . . 0.0 108.697 178.926 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.563 ' HB ' ' HB2' ' A' ' 28' ' ' CYS . 6.5 p -145.74 157.18 43.96 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.411 -0.806 . . . . 0.0 109.668 -179.811 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.558 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 18.4 p -77.93 -35.63 50.24 Favored 'General case' 0 N--CA 1.491 1.578 0 N-CA-C 108.708 -0.849 . . . . 0.0 108.708 179.281 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.522 ' HB2' ' HB2' ' A' ' 29' ' ' ASN . 12.6 mt -146.53 106.58 4.0 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.599 -0.688 . . . . 0.0 109.486 179.638 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.43 ' CH2' HG22 ' A' ' 5' ' ' THR . 13.6 m95 -65.3 111.69 3.13 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 121.555 -0.715 . . . . 0.0 110.497 -179.372 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -92.29 72.07 5.3 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.242 -0.911 . . . . 0.0 109.126 179.276 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.51 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.9 OUTLIER -61.98 110.49 1.58 Allowed 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.204 -0.935 . . . . 0.0 109.277 -179.965 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.421 ' OG ' ' HD2' ' A' ' 22' ' ' PRO . 0.1 OUTLIER -75.2 154.2 86.3 Favored Pre-proline 0 N--CA 1.497 1.905 0 O-C-N 121.298 -0.876 . . . . 0.0 110.036 -179.705 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . 0.421 ' HD2' ' OG ' ' A' ' 21' ' ' SER . 4.7 Cg_exo -53.39 -48.14 23.57 Favored 'Trans proline' 0 C--N 1.319 -1.017 0 C-N-CA 122.762 2.308 . . . . 0.0 111.407 -178.943 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.1 OUTLIER -59.0 -21.58 59.21 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.341 -0.849 . . . . 0.0 110.05 179.503 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.44 50.59 0.65 Allowed Glycine 0 N--CA 1.496 2.689 0 N-CA-C 109.208 -1.557 . . . . 0.0 109.208 -179.81 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 10.6 m-20 -127.46 89.58 50.91 Favored Pre-proline 0 N--CA 1.492 1.658 0 O-C-N 121.574 -0.956 . . . . 0.0 109.994 -179.377 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.51 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 1.4 Cg_endo -66.4 94.51 0.31 Allowed 'Trans proline' 0 C--N 1.312 -1.365 0 C-N-CA 122.299 1.999 . . . . 0.0 110.0 179.434 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.673 HG11 ' OD1' ' A' ' 9' ' ' ASN . 2.4 m -109.69 125.86 66.86 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.066 0 O-C-N 121.06 -1.025 . . . . 0.0 110.52 -179.833 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.563 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 5.2 p -49.98 134.26 21.69 Favored 'General case' 0 N--CA 1.486 1.357 0 O-C-N 121.674 -0.641 . . . . 0.0 110.07 179.786 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.522 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 1.7 t-20 -36.77 -47.74 0.69 Allowed 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.876 -0.515 . . . . 0.0 111.519 -178.952 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -47.39 -46.2 25.86 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.43 -0.794 . . . . 0.0 110.578 -179.66 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.406 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 27.0 m -66.34 -43.8 85.08 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.594 -0.891 . . . . 0.0 108.594 179.21 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.51 -32.17 68.27 Favored Glycine 0 N--CA 1.495 2.628 0 N-CA-C 110.114 -1.194 . . . . 0.0 110.114 179.069 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.408 HD23 ' HA ' ' A' ' 33' ' ' LEU . 61.0 mt -79.53 -62.29 1.74 Allowed 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.334 -1.098 . . . . 0.0 109.844 179.905 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 34.3 t80 -50.99 -36.73 40.72 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.292 -0.88 . . . . 0.0 108.79 179.346 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.512 ' O ' ' N ' ' A' ' 39' ' ' GLN . 31.0 t80 -61.88 -46.49 89.17 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.45 -0.781 . . . . 0.0 109.712 179.298 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -58.84 -22.03 57.96 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.259 -1.525 . . . . 0.0 110.079 179.457 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 8.1 mp -74.54 -71.82 0.32 Allowed 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.976 -1.078 . . . . 0.0 109.851 179.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.452 ' HB2' HG22 ' A' ' 40' ' ' VAL . 51.7 m-70 -93.95 -18.81 21.53 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.309 -0.869 . . . . 0.0 110.477 -179.901 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.512 ' N ' ' O ' ' A' ' 35' ' ' TYR . 2.3 tt0 61.54 53.36 3.36 Favored 'General case' 0 N--CA 1.498 1.929 0 CA-C-O 122.192 0.996 . . . . 0.0 109.951 -179.897 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.452 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.6 m -138.51 168.08 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.252 0 N-CA-C 108.704 -0.85 . . . . 0.0 108.704 179.185 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.403 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 9.7 p-10 -70.24 126.15 28.83 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 120.813 -1.179 . . . . 0.0 109.337 179.917 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.414 ' CD ' ' HD2' ' A' ' 43' ' ' PRO . 5.4 tpt180 -96.62 110.53 53.53 Favored Pre-proline 0 N--CA 1.493 1.706 0 O-C-N 121.205 -0.934 . . . . 0.0 109.735 -179.444 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.414 ' HD2' ' CD ' ' A' ' 42' ' ' ARG . 6.2 Cg_exo -56.15 147.21 66.63 Favored 'Trans proline' 0 C--N 1.318 -1.077 0 C-N-CA 121.976 1.784 . . . . 0.0 110.408 179.272 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.406 ' HB2' ' HD2' ' A' ' 47' ' ' ARG . 0.6 OUTLIER -71.27 7.73 1.22 Allowed 'General case' 0 N--CA 1.5 2.072 0 O-C-N 121.429 -0.794 . . . . 0.0 111.615 -179.795 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 1.7 t -50.25 -30.68 12.26 Favored 'General case' 0 N--CA 1.505 2.283 0 O-C-N 120.905 -1.122 . . . . 0.0 109.933 179.232 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 2.0 ttp -103.56 -24.13 13.44 Favored 'General case' 0 N--CA 1.497 1.895 0 O-C-N 121.342 -0.849 . . . . 0.0 110.227 179.768 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.496 ' HG3' ' HB ' ' A' ' 12' ' ' THR . 0.0 OUTLIER -59.22 143.52 48.81 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.152 -0.967 . . . . 0.0 109.92 -179.858 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.465 ' HB2' ' OE1' ' A' ' 52' ' ' GLN . 0.0 OUTLIER -123.39 157.21 33.88 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.261 -0.899 . . . . 0.0 109.709 179.587 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.4 t70 -71.37 -29.71 65.28 Favored 'General case' 0 N--CA 1.495 1.803 0 O-C-N 121.599 -0.688 . . . . 0.0 110.323 -179.596 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -111.71 132.6 10.95 Favored Glycine 0 N--CA 1.499 2.859 0 N-CA-C 109.877 -1.289 . . . . 0.0 109.877 179.548 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.422 HG13 ' HB ' ' A' ' 14' ' ' THR . 4.9 mt -51.04 125.11 4.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.978 0 O-C-N 121.724 -0.868 . . . . 0.0 110.63 -179.783 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.465 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -73.72 157.17 37.0 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.609 -0.682 . . . . 0.0 109.61 179.24 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -157.06 164.15 38.25 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.01 -1.056 . . . . 0.0 109.825 179.201 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -150.92 -158.79 0.95 Allowed 'General case' 0 N--CA 1.493 1.723 0 O-C-N 121.587 -0.696 . . . . 0.0 109.383 -179.677 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 64.4 t30 -55.83 98.47 0.03 OUTLIER 'General case' 0 N--CA 1.5 2.033 0 O-C-N 120.899 -1.126 . . . . 0.0 108.961 179.215 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 29.0 ttm180 -49.99 139.74 13.38 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.499 -0.751 . . . . 0.0 110.818 -178.602 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -78.22 126.23 30.5 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.584 -0.698 . . . . 0.0 109.432 179.455 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 34.4 m -71.51 -167.17 0.05 OUTLIER 'Isoleucine or valine' 0 N--CA 1.494 1.773 0 O-C-N 121.361 -0.837 . . . . 0.0 109.575 179.577 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.411 ' CB ' ' OP1' ' C' ' 127' ' ' ' DT' . 85.5 p -88.35 147.25 24.85 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.052 -1.03 . . . . 0.0 110.292 179.752 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 30.8 t . . . . . 0 N--CA 1.496 1.838 0 O-C-N 121.152 -0.967 . . . . 0.0 109.276 179.771 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.665 ' N7 ' HD22 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.527 1.987 0 O4'-C1'-N19 110.855 3.819 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.504 ' O6 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.394 1 O4'-C1'-N19 111.25 4.313 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.703 " H2'" ' H72' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.702 1 O4'-C1'-N19 111.006 4.007 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.703 ' H72' " H2'" ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.532 2.661 0 O4'-C1'-N19 110.948 3.935 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.543 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.191 0 O4'-C1'-N19 110.925 3.907 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.417 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.877 0 O4'-C1'-N19 110.881 3.852 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.417 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 O4'--C1' 1.442 1.718 1 O4'-C1'-N19 111.356 4.445 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 P--O5' 1.613 2.036 0 O4'-C1'-N19 110.603 3.504 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.646 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.524 1.614 1 O4'-C1'-N19 111.59 4.738 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.646 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.427 1 O4'-C1'-N19 111.932 5.165 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.466 ' C4 ' ' N3 ' ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.795 1 O4'-C1'-N19 112.35 5.688 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.517 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.142 0 O4'-C1'-N19 110.868 3.834 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.673 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.535 3.061 1 O4'-C1'-N19 111.259 4.323 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.52 H2'' ' C6 ' ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.285 1 O4'-C1'-N19 112.338 5.672 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.52 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.535 2.967 0 O4'-C1'-N19 110.572 3.465 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.506 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.531 2.443 0 O4'-C1'-N19 110.845 3.806 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.501 2.099 0 N-CA-C 110.156 -0.312 . . . . 0.0 110.156 . . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -83.06 12.23 5.31 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 120.976 -1.077 . . . . 0.0 110.211 179.159 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.95 115.56 4.51 Favored 'General case' 0 N--CA 1.494 1.756 0 O-C-N 120.934 -1.103 . . . . 0.0 108.865 179.359 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 126.95 -11.23 6.96 Favored Glycine 0 N--CA 1.497 2.726 0 N-CA-C 110.011 -1.236 . . . . 0.0 110.011 -179.192 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.46 HG22 ' CH2' ' A' ' 18' ' ' TRP . 93.9 m -65.45 88.53 0.09 Allowed 'General case' 0 N--CA 1.493 1.698 0 O-C-N 121.071 -1.253 . . . . 0.0 109.626 179.702 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.571 HG23 ' O ' ' A' ' 6' ' ' VAL . 24.9 m -88.53 112.08 23.4 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.536 0 N-CA-C 107.536 -1.283 . . . . 0.0 107.536 179.16 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.551 ' CB ' HG22 ' A' ' 12' ' ' THR . 52.7 t -46.88 113.36 0.65 Allowed 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.277 -0.889 . . . . 0.0 110.071 -178.486 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 14.1 m -61.17 -14.81 27.82 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.359 -0.838 . . . . 0.0 111.073 -179.484 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.427 ' CB ' ' SG ' ' A' ' 31' ' ' CYS . 12.1 m-20 -94.76 -30.09 14.43 Favored 'General case' 0 N--CA 1.497 1.888 0 O-C-N 120.863 -1.148 . . . . 0.0 110.988 -179.485 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.596 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 18.5 p -139.66 19.84 2.52 Favored 'General case' 0 N--CA 1.501 2.106 0 O-C-N 120.56 -1.338 . . . . 0.0 111.383 179.598 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.439 ' N ' ' O ' ' A' ' 7' ' ' CYS . 3.9 mt-30 45.81 26.17 0.35 Allowed 'General case' 0 N--CA 1.508 2.46 0 O-C-N 121.233 -0.917 . . . . 0.0 111.97 179.014 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.551 HG22 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -84.94 136.7 33.51 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.709 -1.244 . . . . 0.0 109.977 179.684 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.1 p -93.48 1.54 56.76 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.565 -0.71 . . . . 0.0 109.427 178.89 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.466 ' HB ' HG13 ' A' ' 51' ' ' ILE . 79.2 p -127.42 130.9 50.15 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.047 -1.033 . . . . 0.0 110.111 -179.606 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.699 ' C ' HD11 ' A' ' 51' ' ' ILE . 9.3 p -147.89 143.03 27.11 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.443 -0.786 . . . . 0.0 109.771 179.625 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.673 HG21 " H3'" ' C' ' 124' ' ' ' DA' . 44.6 p -72.12 -33.57 67.91 Favored 'General case' 0 N--CA 1.496 1.859 0 N-CA-C 108.072 -1.084 . . . . 0.0 108.072 178.791 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.665 HD22 ' N7 ' ' B' ' 106' ' ' ' DA' . 69.3 mt -142.39 105.54 4.59 Favored 'General case' 0 N--CA 1.491 1.617 0 N-CA-C 108.846 -0.798 . . . . 0.0 108.846 179.067 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.603 ' CZ3' HG21 ' A' ' 15' ' ' THR . 12.5 m95 -64.77 86.34 0.05 Allowed 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.418 -0.802 . . . . 0.0 109.656 -179.877 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.33 81.39 0.37 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.407 -0.808 . . . . 0.0 109.73 -179.795 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.473 ' HD3' ' CA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -61.96 101.45 0.21 Allowed 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.073 -1.017 . . . . 0.0 108.766 179.517 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.4 OUTLIER -53.93 141.72 47.45 Favored Pre-proline 0 N--CA 1.497 1.894 0 O-C-N 121.411 -0.806 . . . . 0.0 109.997 -179.034 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -53.88 -36.21 82.44 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 122.504 2.136 . . . . 0.0 110.962 -179.318 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . 0.45 ' CE ' ' HA ' ' A' ' 23' ' ' MET . 1.1 tpt -60.03 -22.21 62.35 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.365 -0.834 . . . . 0.0 109.871 179.318 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.92 33.25 2.05 Favored Glycine 0 N--CA 1.497 2.722 0 N-CA-C 110.161 -1.176 . . . . 0.0 110.161 179.659 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 21.7 m-20 -126.09 113.0 24.07 Favored Pre-proline 0 N--CA 1.494 1.76 0 O-C-N 121.172 -1.193 . . . . 0.0 110.42 -179.557 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.473 ' CA ' ' HD3' ' A' ' 20' ' ' ARG . 3.2 Cg_exo -64.1 100.1 0.3 Allowed 'Trans proline' 0 C--N 1.316 -1.174 0 C-N-CA 122.313 2.009 . . . . 0.0 110.083 178.879 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.5 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.4 m -119.88 127.17 75.87 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.126 -0.984 . . . . 0.0 110.149 179.947 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.478 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 8.3 p -51.43 136.54 25.44 Favored 'General case' 0 C--N 1.307 -1.281 0 O-C-N 121.479 -0.763 . . . . 0.0 109.397 179.331 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . . . . . . . . . 12.0 t-20 -43.36 -43.42 5.08 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.418 -0.801 . . . . 0.0 111.611 -178.252 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -48.34 -44.38 34.27 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.255 -0.903 . . . . 0.0 110.287 -179.931 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.427 ' SG ' ' CB ' ' A' ' 9' ' ' ASN . 5.4 m -63.69 -43.67 95.94 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.342 -0.849 . . . . 0.0 109.229 179.235 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -63.4 -57.18 15.97 Favored Glycine 0 N--CA 1.495 2.578 0 N-CA-C 110.35 -1.1 . . . . 0.0 110.35 -179.859 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.406 ' HB3' ' H71' ' C' ' 123' ' ' ' DT' . 16.9 mt -60.77 -55.79 28.97 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.452 -1.028 . . . . 0.0 109.357 -179.998 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.454 ' OH ' ' HG3' ' A' ' 42' ' ' ARG . 75.0 t80 -49.95 -43.88 50.23 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.613 -0.68 . . . . 0.0 109.597 179.498 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -56.17 -45.93 79.53 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.301 -0.874 . . . . 0.0 109.285 179.388 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -62.36 -30.94 71.54 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 121.095 -1.003 . . . . 0.0 110.142 179.435 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.418 HD13 ' HA ' ' A' ' 34' ' ' TYR . 4.7 mp -61.73 -65.62 0.66 Allowed 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.098 -1.001 . . . . 0.0 110.625 -179.608 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.829 ' O ' HG22 ' A' ' 40' ' ' VAL . 59.8 m-70 -95.59 9.32 40.61 Favored 'General case' 0 N--CA 1.502 2.129 0 O-C-N 121.221 -0.924 . . . . 0.0 110.532 -179.66 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.409 ' HG2' ' O ' ' A' ' 38' ' ' HIS . 0.0 OUTLIER 41.08 32.51 0.18 Allowed 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.519 -0.738 . . . . 0.0 111.424 -179.182 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.829 HG22 ' O ' ' A' ' 38' ' ' HIS . 4.5 m -145.57 169.77 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.38 0 O-C-N 121.281 -0.887 . . . . 0.0 109.807 179.759 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 2.9 p-10 -85.85 154.23 21.69 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 121.262 -0.898 . . . . 0.0 109.368 178.899 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.454 ' HG3' ' OH ' ' A' ' 34' ' ' TYR . 30.0 mmt180 -149.98 151.18 31.69 Favored Pre-proline 0 N--CA 1.5 2.059 0 O-C-N 121.061 -1.024 . . . . 0.0 109.77 179.519 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 4.3 Cg_exo -59.33 147.51 90.7 Favored 'Trans proline' 0 C--N 1.316 -1.149 0 C-N-CA 122.205 1.936 . . . . 0.0 110.785 179.961 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.596 ' CB ' ' HB2' ' A' ' 10' ' ' CYS . 0.6 OUTLIER -89.73 37.64 0.88 Allowed 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.123 -0.986 . . . . 0.0 110.806 -179.781 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 37.0 p -70.59 -11.28 60.84 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.011 -1.055 . . . . 0.0 109.971 178.894 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 1.4 tmm? -88.1 -18.55 28.6 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.236 -0.915 . . . . 0.0 110.445 179.64 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.489 ' HD3' ' SG ' ' A' ' 10' ' ' CYS . 0.0 OUTLIER -57.24 139.01 53.98 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 120.89 -1.131 . . . . 0.0 110.036 -179.889 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER -99.49 -177.57 3.62 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.387 -0.821 . . . . 0.0 109.493 -179.981 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 11.7 p-10 -64.04 -37.5 87.66 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.253 -0.904 . . . . 0.0 110.032 -179.811 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -142.8 171.21 24.92 Favored Glycine 0 N--CA 1.494 2.546 0 N-CA-C 109.653 -1.379 . . . . 0.0 109.653 179.637 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.699 HD11 ' C ' ' A' ' 15' ' ' THR . 14.5 mt -54.44 121.87 3.42 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.761 0 O-C-N 121.381 -1.07 . . . . 0.0 109.861 179.732 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.51 ' HG2' " C5'" ' C' ' 124' ' ' ' DA' . 0.0 OUTLIER -68.35 146.83 52.9 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 121.39 -0.819 . . . . 0.0 108.822 179.182 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -152.38 157.59 41.5 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.297 -0.877 . . . . 0.0 109.763 179.278 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.426 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -152.44 -168.71 3.13 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 -179.904 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 8.7 p-10 -61.8 105.5 0.56 Allowed 'General case' 0 N--CA 1.494 1.737 0 O-C-N 120.885 -1.134 . . . . 0.0 108.279 179.012 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.494 ' HD3' ' OP1' ' C' ' 126' ' ' ' DC' . 2.8 ptp180 -45.25 135.37 5.86 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 121.286 -0.884 . . . . 0.0 110.048 -178.583 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -50.99 142.8 11.34 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 109.161 -0.681 . . . . 0.0 109.161 179.511 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.1 p -47.34 134.08 4.05 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.919 0 O-C-N 121.504 -0.747 . . . . 0.0 109.565 -179.942 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -50.71 125.85 14.24 Favored 'General case' 0 N--CA 1.497 1.892 0 O-C-N 121.645 -0.659 . . . . 0.0 110.065 -179.329 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 13.2 p . . . . . 0 N--CA 1.499 1.988 0 O-C-N 121.366 -0.834 . . . . 0.0 110.236 179.842 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.716 ' N7 ' HD22 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.525 1.782 0 O4'-C1'-N19 110.341 3.176 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.547 ' O6 ' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.066 1 O4'-C1'-N19 112.579 5.974 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.534 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.534 2.86 1 O4'-C1'-N19 111.202 4.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.555 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.15 1 O4'-C1'-N19 111.244 4.305 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.555 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 P--O5' 1.612 1.863 0 O4'-C1'-N19 110.834 3.793 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.526 1.937 0 O4'-C1'-N19 110.67 3.588 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.445 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.525 1.77 1 O4'-C1'-N19 111.225 4.282 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.445 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.91 0 O4'-C1'-N19 110.468 3.335 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.576 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 P--O5' 1.61 1.749 0 O4'-C1'-N19 110.777 3.722 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.576 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.53 2.402 1 O4'-C1'-N19 111.717 4.896 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . . . . . . . . . . . . . . . . 0 C5'--C4' 1.53 2.359 1 O4'-C1'-N19 111.042 4.052 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.5 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 P--O5' 1.612 1.918 0 O4'-C1'-N19 110.704 3.63 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.74 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.529 2.31 0 O4'-C1'-N19 110.539 3.424 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.535 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.532 2.563 1 O4'-C1'-N19 112.122 5.402 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.472 ' OP1' ' HD2' ' A' ' 56' ' ' ARG . . . . . . . . 0 C5'--C4' 1.532 2.627 0 O4'-C1'-N19 110.66 3.575 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.439 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.533 2.795 1 O4'-C1'-N19 111.007 4.009 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 1.1 mttt . . . . . 0 N--CA 1.494 1.744 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . 0.506 ' HG2' ' OG1' ' A' ' 5' ' ' THR . 6.4 ttt180 -86.72 88.3 7.64 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.407 -0.808 . . . . 0.0 109.67 -179.793 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -68.81 133.24 48.04 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.394 -0.816 . . . . 0.0 109.359 179.809 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 109.03 -30.34 8.77 Favored Glycine 0 N--CA 1.498 2.825 0 N-CA-C 109.531 -1.427 . . . . 0.0 109.531 -179.348 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.726 HG23 ' HB2' ' A' ' 26' ' ' PRO . 16.2 m -78.62 90.24 4.55 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.128 -1.219 . . . . 0.0 109.579 179.654 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.521 HG23 ' O ' ' A' ' 6' ' ' VAL . 27.9 m -81.93 116.13 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.755 -1.202 . . . . 0.0 107.755 179.175 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.467 ' CB ' HG22 ' A' ' 12' ' ' THR . 41.3 t -49.1 113.87 0.89 Allowed 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.203 -0.935 . . . . 0.0 110.11 -178.61 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 4.2 m -60.11 -15.29 22.23 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.635 -0.666 . . . . 0.0 111.141 -179.497 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.417 ' OD1' HG11 ' A' ' 27' ' ' VAL . 5.8 m-20 -96.69 -30.64 13.11 Favored 'General case' 0 N--CA 1.499 1.982 0 O-C-N 120.911 -1.118 . . . . 0.0 111.376 -179.051 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.542 ' O ' ' HB3' ' A' ' 44' ' ' LEU . 15.6 p -140.49 26.16 2.16 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 120.698 -1.251 . . . . 0.0 111.189 179.939 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 52.0 mt-30 40.56 27.88 0.04 OUTLIER 'General case' 0 N--CA 1.509 2.485 0 O-C-N 121.161 -0.962 . . . . 0.0 112.627 178.422 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.467 HG22 ' CB ' ' A' ' 7' ' ' CYS . 14.5 t -89.59 136.78 32.83 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 120.569 -1.332 . . . . 0.0 110.081 179.925 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 5.0 p -92.22 -30.42 15.92 Favored 'General case' 0 N--CA 1.494 1.738 0 O-C-N 121.493 -0.754 . . . . 0.0 109.033 179.168 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.5 p -92.45 125.32 37.05 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.364 -0.835 . . . . 0.0 109.601 -179.939 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.598 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 16.4 p -143.3 148.94 37.12 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.165 -0.96 . . . . 0.0 110.814 179.961 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.74 HG21 " H3'" ' C' ' 124' ' ' ' DA' . 70.6 p -73.87 -33.92 64.25 Favored 'General case' 0 N--CA 1.496 1.829 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 178.956 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.716 HD22 ' N7 ' ' B' ' 106' ' ' ' DA' . 15.6 mt -150.87 105.45 3.27 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.405 -0.81 . . . . 0.0 108.92 179.536 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.598 ' CZ3' HG21 ' A' ' 15' ' ' THR . 7.0 m95 -63.49 84.22 0.03 OUTLIER 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.421 -0.799 . . . . 0.0 110.936 -178.856 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.452 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.3 OUTLIER -80.43 77.51 7.2 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.08 -1.012 . . . . 0.0 109.194 179.36 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.559 ' CB ' ' HA ' ' A' ' 26' ' ' PRO . 5.2 ppt_? -80.0 138.62 37.09 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.022 -1.049 . . . . 0.0 110.033 -179.56 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.1 m -86.89 148.27 45.2 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 121.255 -0.903 . . . . 0.0 109.944 -179.802 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -55.0 -31.3 73.85 Favored 'Trans proline' 0 C--N 1.319 -1.026 0 C-N-CA 122.522 2.148 . . . . 0.0 111.024 -179.7 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -55.04 -28.56 53.12 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 121.409 -0.807 . . . . 0.0 109.803 179.195 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 117.09 34.52 1.22 Allowed Glycine 0 N--CA 1.497 2.713 0 N-CA-C 110.193 -1.163 . . . . 0.0 110.193 179.678 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 6.1 m-20 -130.88 96.03 24.02 Favored Pre-proline 0 N--CA 1.493 1.703 0 O-C-N 121.281 -1.129 . . . . 0.0 109.911 -179.794 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.726 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.3 Cg_endo -65.17 106.21 0.79 Allowed 'Trans proline' 0 C--N 1.314 -1.253 0 C-N-CA 122.465 2.11 . . . . 0.0 110.31 179.381 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.457 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -119.1 129.27 75.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.071 -1.018 . . . . 0.0 110.428 -179.985 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.469 ' HB2' ' HB ' ' A' ' 15' ' ' THR . 6.6 p -52.33 133.57 34.55 Favored 'General case' 0 N--CA 1.484 1.272 0 O-C-N 121.387 -0.82 . . . . 0.0 109.42 179.468 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.41 ' HB2' ' O ' ' A' ' 17' ' ' LEU . 18.9 t-20 -34.34 -49.73 0.39 Allowed 'General case' 0 N--CA 1.508 2.461 0 O-C-N 121.724 -0.61 . . . . 0.0 112.203 -178.445 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -46.82 -49.05 20.65 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.383 -0.823 . . . . 0.0 110.767 -179.424 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.492 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 27.1 m -62.56 -45.46 92.83 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.383 -0.823 . . . . 0.0 109.096 179.533 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -58.21 -30.59 64.4 Favored Glycine 0 N--CA 1.494 2.553 0 N-CA-C 110.46 -1.056 . . . . 0.0 110.46 179.832 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.457 HD23 ' HA ' ' A' ' 33' ' ' LEU . 60.6 mt -80.34 -63.12 1.48 Allowed 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.391 -1.064 . . . . 0.0 109.8 -179.9 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -52.59 -35.17 53.67 Favored 'General case' 0 N--CA 1.5 2.042 0 O-C-N 121.32 -0.862 . . . . 0.0 109.174 179.635 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.6 ' CD1' ' HA ' ' A' ' 39' ' ' GLN . 8.5 t80 -66.37 -52.81 42.99 Favored 'General case' 0 N--CA 1.489 1.516 0 O-C-N 121.515 -0.74 . . . . 0.0 110.232 179.493 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.6 tttt -54.84 -28.42 49.68 Favored 'General case' 0 N--CA 1.502 2.162 0 O-C-N 120.135 -1.603 . . . . 0.0 109.985 -179.992 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 2.6 mp -72.67 -64.37 0.97 Allowed 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.083 -1.011 . . . . 0.0 110.662 -179.988 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.57 ' HB2' HG22 ' A' ' 40' ' ' VAL . 15.1 m-70 -96.87 -28.01 14.42 Favored 'General case' 0 N--CA 1.508 2.45 0 O-C-N 121.141 -0.974 . . . . 0.0 110.653 -179.198 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.6 ' HA ' ' CD1' ' A' ' 35' ' ' TYR . 0.2 OUTLIER 76.08 26.53 0.98 Allowed 'General case' 0 N--CA 1.503 2.191 0 CA-C-O 121.599 0.714 . . . . 0.0 111.039 -179.929 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.57 HG22 ' HB2' ' A' ' 38' ' ' HIS . 3.0 m -113.91 166.93 7.2 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.035 -1.041 . . . . 0.0 109.848 178.63 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.8 p-10 -84.82 130.48 34.66 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.149 -0.969 . . . . 0.0 110.097 -179.874 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . . . . . . . . . 3.5 ttm180 -105.98 137.38 19.35 Favored Pre-proline 0 N--CA 1.495 1.802 0 O-C-N 121.381 -0.825 . . . . 0.0 109.96 -179.554 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.7 Cg_endo -63.57 145.53 91.85 Favored 'Trans proline' 0 C--N 1.316 -1.182 0 C-N-CA 122.237 1.958 . . . . 0.0 110.224 179.204 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.542 ' HB3' ' O ' ' A' ' 10' ' ' CYS . 1.7 pp -72.54 -4.23 29.35 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.206 -0.933 . . . . 0.0 110.943 179.973 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 0.7 OUTLIER -53.64 -26.59 22.92 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.068 -1.02 . . . . 0.0 110.261 179.422 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER -65.94 -26.37 67.56 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.899 -1.125 . . . . 0.0 109.685 179.17 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.02 165.68 24.87 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.182 -0.949 . . . . 0.0 109.687 179.475 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 7.7 mmtt -127.96 -166.18 1.58 Allowed 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.182 -0.949 . . . . 0.0 109.332 -179.938 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 7.3 t70 -46.83 -64.73 0.7 Allowed 'General case' 0 N--CA 1.502 2.149 0 O-C-N 121.315 -0.866 . . . . 0.0 109.958 179.849 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -117.74 -177.13 17.33 Favored Glycine 0 N--CA 1.495 2.58 0 N-CA-C 109.248 -1.541 . . . . 0.0 109.248 179.344 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.552 HG21 HG22 ' A' ' 16' ' ' THR . 5.3 mt -54.43 128.65 14.65 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.772 0 O-C-N 121.144 -1.21 . . . . 0.0 109.912 179.761 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -70.61 144.21 51.25 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.448 -0.782 . . . . 0.0 110.088 -179.933 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.16 160.92 41.28 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.373 -0.83 . . . . 0.0 109.549 178.959 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -151.67 -158.27 0.89 Allowed 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 109.024 -0.732 . . . . 0.0 109.024 179.62 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 50.0 m-20 -58.16 114.97 2.63 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 120.908 -1.12 . . . . 0.0 108.499 179.233 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.472 ' HD2' ' OP1' ' C' ' 126' ' ' ' DC' . 4.1 ttp180 -47.17 141.02 4.71 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.567 -0.708 . . . . 0.0 111.007 -178.622 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -55.48 127.94 32.04 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.585 -0.697 . . . . 0.0 109.74 179.754 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.6 OUTLIER -66.65 158.23 5.36 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.812 0 O-C-N 121.644 -0.66 . . . . 0.0 109.476 179.935 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 1.8 p -64.1 135.34 56.29 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.065 -1.022 . . . . 0.0 109.312 179.909 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 29.6 t . . . . . 0 N--CA 1.495 1.81 0 O-C-N 121.281 -0.887 . . . . 0.0 109.006 -179.558 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.622 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 P--O5' 1.613 1.999 0 O4'-C1'-N19 110.817 3.771 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.622 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.029 1 O4'-C1'-N19 111.441 4.552 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.617 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.307 0 O4'-C1'-N19 110.957 3.946 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.617 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 2.005 0 O4'-C1'-N19 110.817 3.771 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.552 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.915 0 O4'-C1'-N19 110.67 3.588 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.421 ' C8 ' H2'' ' B' ' 110' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.909 0 O4'-C1'-N19 110.899 3.873 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.401 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.525 1.801 1 O4'-C1'-N19 111.65 4.813 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . . . . . . . . . . . . . . . . 0 O4'--C1' 1.443 1.787 0 O4'-C1'-N19 110.542 3.427 . . . . 0.0 . . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.7 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.525 1.737 1 O4'-C1'-N19 111.457 4.571 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.7 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.533 2.715 1 O4'-C1'-N19 111.959 5.199 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.607 ' OP2' HD23 ' A' ' 37' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.342 1 O4'-C1'-N19 111.243 4.304 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.498 ' H71' ' HB3' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.528 2.141 0 O4'-C1'-N19 110.496 3.37 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.669 " H3'" HG21 ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.534 2.852 0 O4'-C1'-N19 110.654 3.568 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.744 ' O4 ' HD11 ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.419 1 O4'-C1'-N19 112.266 5.583 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.495 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.535 2.971 0 O4'-C1'-N19 110.909 3.886 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.464 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.533 2.783 0 O4'-C1'-N19 110.9 3.875 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.495 1.816 0 N-CA-C 109.433 -0.581 . . . . 0.0 109.433 . . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -82.92 -26.3 31.58 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.325 -0.86 . . . . 0.0 109.344 179.964 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -67.37 107.6 2.47 Favored 'General case' 0 N--CA 1.494 1.733 0 N-CA-C 108.585 -0.894 . . . . 0.0 108.585 179.072 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . 0.438 ' O ' HG13 ' A' ' 6' ' ' VAL . . . 126.2 -12.49 7.16 Favored Glycine 0 N--CA 1.495 2.604 0 N-CA-C 110.218 -1.153 . . . . 0.0 110.218 -179.333 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.512 HG23 ' CB ' ' A' ' 26' ' ' PRO . 17.4 m -54.4 100.58 0.03 OUTLIER 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.025 -1.279 . . . . 0.0 108.942 179.188 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.438 HG13 ' O ' ' A' ' 4' ' ' GLY . 9.7 m -87.03 137.37 21.04 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.724 0 O-C-N 120.987 -1.071 . . . . 0.0 108.981 -179.454 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.534 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 31.9 t -67.02 117.57 9.26 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.335 -0.853 . . . . 0.0 110.583 -179.257 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.8 m -63.05 -7.61 5.8 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.381 -0.824 . . . . 0.0 110.545 178.913 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.429 ' HB3' ' SG ' ' A' ' 31' ' ' CYS . 1.2 m-80 -109.82 -28.14 8.94 Favored 'General case' 0 N--CA 1.496 1.847 0 O-C-N 120.93 -1.106 . . . . 0.0 111.177 -179.389 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.53 ' HB2' ' CB ' ' A' ' 44' ' ' LEU . 14.6 p -142.5 17.22 2.03 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 120.501 -1.375 . . . . 0.0 111.59 -179.813 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . . . . . . . . . 6.8 mt-30 47.64 26.3 0.82 Allowed 'General case' 0 N--CA 1.505 2.307 0 O-C-N 121.21 -0.931 . . . . 0.0 112.116 178.576 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.458 ' H ' ' HB3' ' A' ' 7' ' ' CYS . 3.3 t -90.11 128.7 36.38 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.582 -1.324 . . . . 0.0 109.521 179.147 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -89.48 -27.99 19.97 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 108.84 -0.8 . . . . 0.0 108.84 179.849 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 2.3 p -88.8 106.59 18.47 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.483 -0.761 . . . . 0.0 109.562 179.8 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.613 HG21 ' CH2' ' A' ' 18' ' ' TRP . 17.8 p -128.34 157.05 42.05 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.449 -0.782 . . . . 0.0 110.212 -179.69 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.719 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 40.8 p -86.31 -39.68 16.25 Favored 'General case' 0 N--CA 1.489 1.513 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 178.946 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.744 HD11 ' O4 ' ' C' ' 125' ' ' ' DT' . 23.3 mt -138.04 102.27 4.64 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.435 -0.79 . . . . 0.0 109.417 179.638 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.613 ' CH2' HG21 ' A' ' 15' ' ' THR . 5.7 m95 -62.9 106.76 0.86 Allowed 'General case' 0 N--CA 1.493 1.709 0 O-C-N 121.39 -0.819 . . . . 0.0 110.148 -179.902 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 1.2 tmm_? -97.42 73.87 2.44 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.445 -0.785 . . . . 0.0 109.384 179.828 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.494 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -67.04 112.37 4.35 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.224 -0.922 . . . . 0.0 109.124 179.898 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 0.5 OUTLIER -69.04 150.99 97.41 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 121.178 -0.951 . . . . 0.0 109.434 -179.903 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -52.81 -41.06 72.69 Favored 'Trans proline' 0 C--N 1.317 -1.091 0 C-N-CA 122.486 2.124 . . . . 0.0 111.186 -179.147 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -56.45 -25.29 50.22 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.264 -0.897 . . . . 0.0 110.06 179.331 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 112.5 44.43 0.84 Allowed Glycine 0 N--CA 1.497 2.746 0 N-CA-C 109.95 -1.26 . . . . 0.0 109.95 179.767 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 25.5 m-20 -128.08 98.74 26.3 Favored Pre-proline 0 N--CA 1.494 1.769 0 O-C-N 121.326 -1.103 . . . . 0.0 110.46 -179.652 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.531 ' O ' ' HA ' ' A' ' 7' ' ' CYS . 2.0 Cg_endo -66.5 94.91 0.32 Allowed 'Trans proline' 0 C--N 1.314 -1.266 0 C-N-CA 122.372 2.048 . . . . 0.0 109.998 178.811 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.534 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.3 m -114.08 123.71 70.01 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 120.961 -1.087 . . . . 0.0 110.406 179.93 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 7.6 p -48.42 132.8 16.67 Favored 'General case' 0 N--CA 1.485 1.319 0 O-C-N 121.64 -0.663 . . . . 0.0 109.379 179.338 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.605 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 2.1 t-20 -40.44 -40.98 1.31 Allowed 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.658 -0.652 . . . . 0.0 111.568 -177.943 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -50.58 -43.98 56.7 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 120.96 -1.088 . . . . 0.0 110.478 179.773 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.429 ' SG ' ' HB3' ' A' ' 9' ' ' ASN . 13.3 m -65.73 -39.2 90.89 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.314 -0.866 . . . . 0.0 109.265 179.445 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -70.14 -53.98 12.69 Favored Glycine 0 N--CA 1.496 2.697 0 N-CA-C 110.979 -0.848 . . . . 0.0 110.979 -179.634 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.498 ' HB3' ' H71' ' C' ' 123' ' ' ' DT' . 48.0 mt -57.32 -57.2 13.66 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.341 -1.094 . . . . 0.0 109.941 -179.462 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.554 ' OH ' ' HD2' ' A' ' 42' ' ' ARG . 78.5 t80 -50.67 -43.97 57.61 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 179.583 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.617 ' O ' ' N ' ' A' ' 39' ' ' GLN . 27.4 t80 -57.57 -54.79 42.82 Favored 'General case' 0 C--O 1.195 -1.811 0 O-C-N 121.502 -0.749 . . . . 0.0 109.402 179.456 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 2.5 tttt -49.42 -34.35 16.24 Favored 'General case' 0 N--CA 1.508 2.463 0 O-C-N 119.932 -1.73 . . . . 0.0 111.096 179.781 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.607 HD23 ' OP2' ' C' ' 122' ' ' ' DT' . 9.6 mp -57.94 -65.12 0.69 Allowed 'General case' 0 N--CA 1.508 2.428 0 O-C-N 121.082 -1.011 . . . . 0.0 110.408 -179.638 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . . . . . . . . . 56.2 m-70 -99.11 -33.15 10.9 Favored 'General case' 0 N--CA 1.506 2.364 0 O-C-N 121.256 -0.903 . . . . 0.0 109.03 179.549 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.617 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.0 OUTLIER 73.2 47.99 0.18 Allowed 'General case' 0 N--CA 1.493 1.683 0 CA-C-O 121.868 0.842 . . . . 0.0 110.099 179.088 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . . . . . . . . . 2.7 m -140.57 166.26 19.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.135 0 N-CA-C 108.366 -0.975 . . . . 0.0 108.366 178.544 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 20.1 p30 -77.61 145.52 36.73 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 120.854 -1.154 . . . . 0.0 109.396 179.753 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.554 ' HD2' ' OH ' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -146.22 150.23 40.77 Favored Pre-proline 0 N--CA 1.494 1.746 0 O-C-N 120.918 -1.114 . . . . 0.0 110.125 -179.686 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.441 ' HD2' ' HD3' ' A' ' 42' ' ' ARG . 5.9 Cg_exo -57.18 147.43 76.09 Favored 'Trans proline' 0 C--N 1.314 -1.243 0 C-N-CA 122.227 1.952 . . . . 0.0 110.796 -179.947 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.547 HD23 ' H ' ' A' ' 44' ' ' LEU . 0.4 OUTLIER -86.59 23.93 1.54 Allowed 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.498 -0.751 . . . . 0.0 110.591 179.993 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 70.5 p -68.67 -12.69 61.69 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 120.999 -1.063 . . . . 0.0 110.336 179.374 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.9 OUTLIER -86.11 -31.27 21.97 Favored 'General case' 0 N--CA 1.498 1.941 0 O-C-N 121.252 -0.905 . . . . 0.0 110.303 -179.83 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.488 ' HG2' ' N ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -80.62 158.49 25.67 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.11 -0.994 . . . . 0.0 109.775 -179.814 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.488 ' N ' ' HG2' ' A' ' 47' ' ' ARG . 10.3 tttp -131.78 173.56 11.04 Favored 'General case' 0 N--CA 1.497 1.908 0 O-C-N 121.054 -1.029 . . . . 0.0 109.93 179.78 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 0.6 OUTLIER -69.48 -37.72 77.38 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.354 -0.841 . . . . 0.0 109.586 179.854 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -97.63 132.32 10.93 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.89 -1.684 . . . . 0.0 108.89 179.158 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.566 HG21 HG22 ' A' ' 16' ' ' THR . 4.8 mt -53.47 104.04 0.07 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.387 -1.066 . . . . 0.0 109.912 -179.626 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . 0.475 ' OE1' ' HB2' ' A' ' 48' ' ' LYS . 1.9 mt-30 -46.5 96.76 0.01 OUTLIER 'General case' 0 N--CA 1.499 2.009 0 O-C-N 122.047 -0.408 . . . . 0.0 111.041 -179.363 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.449 HG22 ' O ' ' A' ' 51' ' ' ILE . 0.3 OUTLIER -121.86 153.04 38.91 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.949 -1.094 . . . . 0.0 110.859 179.583 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.55 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 1.6 ptm180 -154.17 -154.45 0.52 Allowed 'General case' 0 N--CA 1.493 1.706 0 CA-C-N 115.541 -0.754 . . . . 0.0 108.971 179.5 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . 0.48 ' N ' ' HG3' ' A' ' 54' ' ' ARG . 23.7 t-20 -58.54 121.09 10.1 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.21 -1.033 . . . . 0.0 108.21 177.988 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . 0.455 ' CB ' " H4'" ' C' ' 125' ' ' ' DT' . 0.0 OUTLIER -86.14 -169.43 2.64 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.419 -0.8 . . . . 0.0 111.083 -178.449 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -84.19 157.04 21.78 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.305 -0.872 . . . . 0.0 109.645 179.904 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . 0.48 HG22 ' N ' ' A' ' 59' ' ' SER . 14.6 p -79.99 166.43 2.5 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.838 0 N-CA-C 108.788 -0.819 . . . . 0.0 108.788 178.837 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . 0.48 ' N ' HG22 ' A' ' 58' ' ' VAL . 12.4 p -54.44 113.48 1.29 Allowed 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.905 -1.122 . . . . 0.0 109.124 179.588 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 3.5 t . . . . . 0 N--CA 1.495 1.823 0 O-C-N 121.451 -0.781 . . . . 0.0 110.731 -178.91 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.545 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.527 1.957 0 O4'-C1'-N19 110.708 3.635 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.562 ' N7 ' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.526 1.814 1 O4'-C1'-N19 111.874 5.092 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.553 H2'' " O5'" ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.528 2.076 1 O4'-C1'-N19 111.043 4.054 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.553 " O5'" H2'' ' B' ' 108' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.105 1 O4'-C1'-N19 111.05 4.063 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.546 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 O4'--C1' 1.444 1.868 0 O4'-C1'-N19 110.524 3.405 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.41 " H2'" ' C8 ' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.158 0 O4'-C1'-N19 110.68 3.601 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.442 H2'' " O5'" ' B' ' 113' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.527 2.04 1 O4'-C1'-N19 111.202 4.253 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.442 " O5'" H2'' ' B' ' 112' ' ' ' DA' . . . . . . . . 0 P--O5' 1.612 1.901 0 C3'-C2'-C1' 107.177 3.198 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.654 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.813 1 O4'-C1'-N19 111.113 4.141 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.654 " O5'" H2'' ' C' ' 120' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.533 2.781 1 O4'-C1'-N19 111.877 5.097 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.438 ' H71' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.468 1 O4'-C1'-N19 111.01 4.012 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.584 ' H73' ' HB3' ' A' ' 33' ' ' LEU . . . . . . . . 0 C5'--C4' 1.529 2.237 0 O4'-C1'-N19 110.633 3.541 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.466 ' C8 ' H2'' ' C' ' 123' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.728 0 O4'-C1'-N19 110.62 3.525 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.627 ' C7 ' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.533 2.71 1 O4'-C1'-N19 112.435 5.794 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.492 ' C6 ' H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.536 3.098 0 O4'-C1'-N19 110.578 3.473 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.455 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.528 2.174 0 O4'-C1'-N19 110.749 3.686 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 23.5 mttt . . . . . 0 N--CA 1.498 1.948 0 CA-C-O 120.919 0.39 . . . . 0.0 110.077 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 9.1 mmm180 -81.6 74.65 8.58 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.15 -0.969 . . . . 0.0 110.008 -179.576 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -62.23 113.79 3.08 Favored 'General case' 0 N--CA 1.497 1.923 0 O-C-N 121.473 -0.767 . . . . 0.0 109.294 179.608 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 123.9 -30.26 4.89 Favored Glycine 0 N--CA 1.496 2.682 0 N-CA-C 109.385 -1.486 . . . . 0.0 109.385 -179.202 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . 0.623 HG23 ' HB2' ' A' ' 26' ' ' PRO . 4.9 m -72.18 88.93 1.15 Allowed 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.266 -1.138 . . . . 0.0 109.472 179.505 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . 0.493 HG23 ' O ' ' A' ' 6' ' ' VAL . 15.9 m -78.73 120.19 29.31 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.658 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 179.124 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.562 ' HB2' HG22 ' A' ' 12' ' ' THR . 45.3 t -49.42 112.78 0.69 Allowed 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.191 -0.943 . . . . 0.0 110.585 -178.411 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 71.0 m -57.19 -16.97 9.29 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.412 -0.805 . . . . 0.0 110.839 179.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . 0.472 ' CB ' ' SG ' ' A' ' 31' ' ' CYS . 25.3 m-20 -98.87 -31.01 12.07 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.002 -1.061 . . . . 0.0 111.437 -179.206 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.481 ' O ' ' HG2' ' A' ' 11' ' ' GLN . 19.1 p -138.73 22.02 2.68 Favored 'General case' 0 N--CA 1.502 2.17 0 O-C-N 120.468 -1.395 . . . . 0.0 111.474 179.294 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.481 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER 44.59 21.02 0.04 OUTLIER 'General case' 0 N--CA 1.51 2.572 0 O-C-N 121.303 -0.873 . . . . 0.0 112.692 178.851 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.562 HG22 ' HB2' ' A' ' 7' ' ' CYS . 6.1 t -80.78 130.48 35.09 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.579 -1.325 . . . . 0.0 109.749 179.927 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 15.0 p -90.47 -4.93 56.63 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 121.29 -0.881 . . . . 0.0 109.42 179.47 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.418 ' HB ' HG13 ' A' ' 51' ' ' ILE . 31.9 p -118.65 121.45 40.18 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.185 -0.947 . . . . 0.0 110.085 -179.616 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.603 HG23 ' CZ2' ' A' ' 18' ' ' TRP . 21.5 p -143.58 160.88 39.85 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.323 -0.861 . . . . 0.0 110.117 179.475 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.627 ' HB ' ' C7 ' ' C' ' 125' ' ' ' DT' . 21.3 p -81.52 -47.45 13.1 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 108.192 -1.04 . . . . 0.0 108.192 178.877 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.562 ' CD1' ' N7 ' ' B' ' 107' ' ' ' DG' . 10.9 mt -130.94 109.92 10.89 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.686 -0.633 . . . . 0.0 109.37 179.206 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.603 ' CZ2' HG23 ' A' ' 15' ' ' THR . 16.7 m95 -79.34 85.83 5.13 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.577 -0.702 . . . . 0.0 109.79 -179.615 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . 0.598 ' HD3' ' HA ' ' A' ' 29' ' ' ASN . 0.1 OUTLIER -77.57 93.64 4.22 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.073 -1.017 . . . . 0.0 109.335 179.556 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.477 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.0 OUTLIER -68.06 124.21 22.77 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.33 -0.856 . . . . 0.0 110.149 -179.27 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 3.3 m -81.26 141.17 49.46 Favored Pre-proline 0 N--CA 1.499 1.989 0 O-C-N 121.361 -0.837 . . . . 0.0 109.559 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -54.36 -41.17 78.91 Favored 'Trans proline' 0 C--N 1.317 -1.087 0 C-N-CA 122.515 2.144 . . . . 0.0 110.933 -179.766 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 6.3 mtp -59.78 -20.44 56.74 Favored 'General case' 0 N--CA 1.499 1.996 0 O-C-N 121.32 -0.863 . . . . 0.0 109.95 179.386 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 110.54 39.66 1.44 Allowed Glycine 0 N--CA 1.495 2.623 0 N-CA-C 109.962 -1.255 . . . . 0.0 109.962 179.827 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -127.6 91.19 46.3 Favored Pre-proline 0 N--CA 1.494 1.755 0 O-C-N 121.379 -1.071 . . . . 0.0 110.146 -179.818 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.623 ' HB2' HG23 ' A' ' 5' ' ' THR . 2.6 Cg_endo -64.36 100.3 0.32 Allowed 'Trans proline' 0 C--N 1.311 -1.424 0 C-N-CA 122.203 1.935 . . . . 0.0 109.524 179.064 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.463 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 2.0 m -109.12 153.88 10.73 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 120.869 -1.144 . . . . 0.0 110.998 -179.476 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.507 ' CB ' ' CG2' ' A' ' 15' ' ' THR . 16.0 p -81.8 138.88 35.06 Favored 'General case' 0 C--N 1.302 -1.474 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -179.988 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.598 ' HA ' ' HD3' ' A' ' 19' ' ' ARG . 6.0 t-20 -38.12 -36.64 0.22 Allowed 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.781 -0.575 . . . . 0.0 111.812 -178.64 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.69 -43.07 81.01 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.271 -0.893 . . . . 0.0 111.76 -179.038 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.472 ' SG ' ' CB ' ' A' ' 9' ' ' ASN . 1.8 m -57.98 -41.01 82.07 Favored 'General case' 0 N--CA 1.503 2.193 0 O-C-N 121.001 -1.062 . . . . 0.0 109.621 -179.671 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . 0.455 ' HA3' ' CZ ' ' A' ' 19' ' ' ARG . . . -74.02 -39.59 45.46 Favored Glycine 0 N--CA 1.491 2.309 0 N-CA-C 110.184 -1.166 . . . . 0.0 110.184 -179.925 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.584 ' HB3' ' H73' ' C' ' 123' ' ' ' DT' . 25.0 mt -64.65 -65.15 0.71 Allowed 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.484 -1.01 . . . . 0.0 110.26 -179.616 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.792 ' HA ' HD22 ' A' ' 37' ' ' LEU . 23.3 t80 -51.74 -39.98 59.44 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 121.233 -0.917 . . . . 0.0 108.843 179.77 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.485 ' O ' ' N ' ' A' ' 39' ' ' GLN . 60.2 t80 -53.59 -47.81 69.81 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.564 -0.71 . . . . 0.0 109.633 179.198 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.1 tttp -66.99 -38.67 86.44 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.208 -0.933 . . . . 0.0 110.14 -179.902 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.792 HD22 ' HA ' ' A' ' 34' ' ' TYR . 0.4 OUTLIER -45.27 -53.21 8.67 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.293 -0.879 . . . . 0.0 110.031 -179.564 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.543 ' CB ' HG22 ' A' ' 40' ' ' VAL . 37.6 m-70 -111.53 6.37 20.07 Favored 'General case' 0 N--CA 1.496 1.862 0 O-C-N 121.351 -0.843 . . . . 0.0 109.549 179.156 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.485 ' N ' ' O ' ' A' ' 35' ' ' TYR . 3.2 tp-100 49.22 32.67 4.42 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.431 -0.793 . . . . 0.0 110.133 -178.751 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.543 HG22 ' CB ' ' A' ' 38' ' ' HIS . 4.0 m -134.08 -174.44 1.18 Allowed 'Isoleucine or valine' 0 N--CA 1.485 1.323 0 O-C-N 121.503 -0.748 . . . . 0.0 109.558 179.826 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 13.2 p30 -61.97 172.5 1.35 Allowed 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.237 -0.915 . . . . 0.0 110.319 179.574 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.597 ' HB3' ' CD1' ' A' ' 34' ' ' TYR . 0.0 OUTLIER -133.36 131.38 21.51 Favored Pre-proline 0 N--CA 1.496 1.872 0 O-C-N 121.24 -0.912 . . . . 0.0 109.451 -179.867 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.6 Cg_endo -63.24 112.93 1.85 Allowed 'Trans proline' 0 C--N 1.315 -1.218 0 C-N-CA 122.135 1.89 . . . . 0.0 110.335 179.857 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.586 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -72.74 -7.24 49.61 Favored 'General case' 0 N--CA 1.499 2.009 0 O-C-N 121.21 -0.931 . . . . 0.0 110.378 179.779 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 75.0 p -54.42 -20.66 7.9 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 121.05 -1.031 . . . . 0.0 110.003 178.631 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -71.03 -15.36 62.55 Favored 'General case' 0 N--CA 1.498 1.96 0 O-C-N 121.139 -0.975 . . . . 0.0 110.725 179.627 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.487 ' HG2' ' O ' ' A' ' 44' ' ' LEU . 12.0 mmm180 -56.56 148.03 20.69 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 120.719 -1.238 . . . . 0.0 110.24 -179.785 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -131.85 -162.92 1.27 Allowed 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.42 -0.8 . . . . 0.0 109.852 -179.916 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -79.99 -41.17 26.4 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.12 -0.988 . . . . 0.0 109.884 179.982 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -133.15 165.89 23.88 Favored Glycine 0 N--CA 1.498 2.793 0 N-CA-C 109.94 -1.264 . . . . 0.0 109.94 -179.996 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.418 HG13 ' HB ' ' A' ' 14' ' ' THR . 5.4 mt -56.59 125.87 13.08 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.824 0 O-C-N 121.195 -1.18 . . . . 0.0 109.973 179.87 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -63.63 154.53 32.58 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.561 -0.712 . . . . 0.0 109.589 179.247 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . . . . . . . . . 0.0 OUTLIER -155.84 165.32 36.83 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 120.977 -1.077 . . . . 0.0 109.252 179.1 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.435 HH11 ' CG ' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -150.46 -172.68 4.24 Favored 'General case' 0 N--CA 1.492 1.665 0 O-C-N 121.539 -0.725 . . . . 0.0 109.382 -179.421 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 2.9 t-20 -51.69 118.69 3.55 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.106 -0.996 . . . . 0.0 108.718 179.228 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 5.9 ttm180 -47.43 140.58 5.62 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.581 -0.7 . . . . 0.0 110.351 -178.985 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 6.2 ttmt -54.25 134.95 44.94 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.581 -0.699 . . . . 0.0 110.149 -179.742 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 0.8 OUTLIER -59.38 137.27 22.04 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.495 -0.753 . . . . 0.0 109.415 179.69 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.2 OUTLIER -75.77 115.04 15.05 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.256 -0.903 . . . . 0.0 109.778 -179.566 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 8.0 t . . . . . 0 N--CA 1.494 1.736 0 O-C-N 121.23 -0.919 . . . . 0.0 110.306 -179.873 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 106' ' ' ' DA' . . . . . 0.505 H2'' " O5'" ' B' ' 107' ' ' ' DG' . . . . . . . . 0 C5'--C4' 1.526 1.928 0 O4'-C1'-N19 110.702 3.627 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 107' ' ' ' DG' . . . . . 0.505 " O5'" H2'' ' B' ' 106' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.526 1.932 1 O4'-C1'-N19 111.469 4.586 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 108' ' ' ' DA' . . . . . 0.531 ' N6 ' ' CD1' ' A' ' 17' ' ' LEU . . . . . . . . 0 C5'--C4' 1.53 2.349 1 O4'-C1'-N19 111.043 4.054 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 109' ' ' ' DT' . . . . . 0.533 H2'' " O5'" ' B' ' 110' ' ' ' DA' . . . . . . . . 0 P--O5' 1.615 2.211 0 O4'-C1'-N19 110.901 3.877 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 110' ' ' ' DA' . . . . . 0.533 " O5'" H2'' ' B' ' 109' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.529 2.208 0 O4'-C1'-N19 110.778 3.723 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 111' ' ' ' DA' . . . . . 0.401 H2'' " O5'" ' B' ' 112' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.97 0 O4'-C1'-N19 110.855 3.818 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 112' ' ' ' DA' . . . . . 0.401 " O5'" H2'' ' B' ' 111' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.527 1.955 1 O4'-C1'-N19 111.711 4.889 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 113' ' ' ' DC' . . . . . 0.4 " H5'" ' NE ' ' A' ' 54' ' ' ARG . . . . . . . . 0 P--O5' 1.612 1.926 0 O4'-C1'-N19 110.558 3.447 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 120' ' ' ' DG' . . . . . 0.664 H2'' " O5'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.526 1.921 1 O4'-C1'-N19 111.152 4.19 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 121' ' ' ' DT' . . . . . 0.686 " H2'" ' H72' ' C' ' 122' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.775 1 O4'-C1'-N19 111.864 5.08 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 122' ' ' ' DT' . . . . . 0.686 ' H72' " H2'" ' C' ' 121' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.713 1 O4'-C1'-N19 111.434 4.543 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 123' ' ' ' DT' . . . . . 0.488 H2'' ' C8 ' ' C' ' 124' ' ' ' DA' . . . . . . . . 0 C5'--C4' 1.528 2.112 0 O4'-C1'-N19 110.912 3.89 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 124' ' ' ' DA' . . . . . 0.537 " H2'" ' H71' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.531 2.466 0 O4'-C1'-N19 110.816 3.769 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 125' ' ' ' DT' . . . . . 0.686 ' H71' ' HB ' ' A' ' 16' ' ' THR . . . . . . . . 0 C5'--C4' 1.528 2.127 1 O4'-C1'-N19 111.965 5.206 . . . . 0.0 . . . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' C' C ' 126' ' ' ' DC' . . . . . 0.608 " O5'" H2'' ' C' ' 125' ' ' ' DT' . . . . . . . . 0 C5'--C4' 1.533 2.695 0 O4'-C1'-N19 110.407 3.258 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' C' C ' 127' ' ' ' DT' . . . . . 0.46 ' C5 ' " H2'" ' C' ' 126' ' ' ' DC' . . . . . . . . 0 C5'--C4' 1.529 2.306 0 O4'-C1'-N19 110.646 3.557 . . . . 0.0 . . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.496 1.854 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' ARG . . . . . . . . . . . . . 16.9 mmt180 -83.65 2.33 38.06 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.312 -0.868 . . . . 0.0 110.4 179.718 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -58.4 119.52 7.12 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.251 -0.906 . . . . 0.0 109.039 179.209 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLY . . . . . . . . . . . . . . . 127.3 -23.83 5.41 Favored Glycine 0 N--CA 1.496 2.649 0 N-CA-C 109.266 -1.534 . . . . 0.0 109.266 -178.947 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' THR . . . . . . . . . . . . . 31.0 m -69.13 93.36 0.59 Allowed 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.31 -1.112 . . . . 0.0 109.843 179.613 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' VAL . . . . . . . . . . . . . 0.0 OUTLIER -103.68 129.74 55.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 107.47 -1.308 . . . . 0.0 107.47 178.41 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' CYS . . . . . 0.508 ' SG ' ' HA ' ' A' ' 27' ' ' VAL . 6.9 t -45.13 111.98 0.39 Allowed 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.523 -0.736 . . . . 0.0 111.132 -178.638 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' SER . . . . . . . . . . . . . 17.7 m -60.58 -13.32 13.53 Favored 'General case' 0 N--CA 1.501 2.083 0 O-C-N 121.25 -0.906 . . . . 0.0 110.671 179.679 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' ASN . . . . . . . . . . . . . 6.5 m-80 -105.03 -28.59 10.96 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 120.776 -1.203 . . . . 0.0 111.589 -179.309 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' CYS . . . . . 0.623 ' SG ' ' HD2' ' A' ' 47' ' ' ARG . 9.4 p -138.71 24.7 2.62 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 120.637 -1.289 . . . . 0.0 110.59 179.005 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' GLN . . . . . 0.528 ' HG2' ' O ' ' A' ' 10' ' ' CYS . 1.3 pt20 38.45 25.98 0.01 OUTLIER 'General case' 0 N--CA 1.512 2.657 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 179.132 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' THR . . . . . 0.466 HG22 ' HB2' ' A' ' 7' ' ' CYS . 3.8 t -90.1 124.18 34.59 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.589 -1.319 . . . . 0.0 109.816 179.228 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' SER . . . . . . . . . . . . . 0.1 OUTLIER -90.07 -23.96 21.28 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.447 -0.783 . . . . 0.0 109.711 -179.867 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . 0.513 ' HB ' HG13 ' A' ' 51' ' ' ILE . 2.9 p -89.86 94.13 9.7 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.225 -0.922 . . . . 0.0 109.173 179.807 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' THR . . . . . 0.544 HG21 ' CZ3' ' A' ' 18' ' ' TRP . 5.2 p -117.71 149.59 40.5 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.269 -0.895 . . . . 0.0 110.059 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . 0.686 ' HB ' ' H71' ' C' ' 125' ' ' ' DT' . 30.7 p -74.04 -33.72 63.83 Favored 'General case' 0 N--CA 1.495 1.811 0 N-CA-C 108.604 -0.887 . . . . 0.0 108.604 179.145 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' LEU . . . . . 0.531 ' CD1' ' N6 ' ' B' ' 108' ' ' ' DA' . 73.3 mt -146.32 108.52 4.42 Favored 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 179.34 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' TRP . . . . . 0.544 ' CZ3' HG21 ' A' ' 15' ' ' THR . 9.6 m95 -65.39 86.33 0.07 Allowed 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.382 -0.824 . . . . 0.0 109.696 -179.774 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' ARG . . . . . . . . . . . . . 5.0 ttt180 -76.98 80.25 3.52 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.433 -0.792 . . . . 0.0 109.381 -179.896 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ARG . . . . . 0.486 ' HA ' ' HA ' ' A' ' 26' ' ' PRO . 0.2 OUTLIER -57.91 123.45 15.84 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.364 -0.835 . . . . 0.0 109.594 -179.832 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . . . . . . . . . 4.0 t -78.58 145.99 68.53 Favored Pre-proline 0 N--CA 1.496 1.858 0 O-C-N 121.346 -0.846 . . . . 0.0 109.912 -179.599 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' PRO . . . . . . . . . . . . . 3.7 Cg_exo -58.76 -23.17 65.28 Favored 'Trans proline' 0 C--N 1.319 -1.024 0 C-N-CA 122.443 2.095 . . . . 0.0 110.482 179.185 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -78.04 1.28 21.47 Favored 'General case' 0 N--CA 1.495 1.777 0 O-C-N 121.207 -0.933 . . . . 0.0 110.307 179.309 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' GLY . . . . . . . . . . . . . . . 88.85 29.89 16.72 Favored Glycine 0 N--CA 1.497 2.741 0 N-CA-C 109.412 -1.475 . . . . 0.0 109.412 -179.562 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -121.34 101.03 44.4 Favored Pre-proline 0 N--CA 1.492 1.653 0 O-C-N 121.406 -1.055 . . . . 0.0 110.339 -179.419 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' PRO . . . . . 0.486 ' HA ' ' HA ' ' A' ' 20' ' ' ARG . 3.2 Cg_exo -63.11 99.69 0.23 Allowed 'Trans proline' 0 C--N 1.311 -1.417 0 C-N-CA 121.997 1.798 . . . . 0.0 109.605 178.48 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.508 ' HA ' ' SG ' ' A' ' 7' ' ' CYS . 1.6 m -110.34 154.56 11.86 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.93 0 CA-C-O 122.292 1.044 . . . . 0.0 111.024 -179.77 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.405 ' O ' ' C ' ' A' ' 29' ' ' ASN . 15.7 p -81.14 138.37 35.9 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 108.971 -0.751 . . . . 0.0 108.971 -179.689 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' ASN . . . . . 0.423 ' HB2' ' HB2' ' A' ' 17' ' ' LEU . 3.5 t-20 -35.22 -46.8 0.37 Allowed 'General case' 0 N--CA 1.504 2.275 0 O-C-N 121.657 -0.652 . . . . 0.0 112.093 -178.551 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . 0.437 ' HB3' HH12 ' A' ' 47' ' ' ARG . . . -55.15 -47.26 75.37 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 121.377 -0.827 . . . . 0.0 111.472 -179.339 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' CYS . . . . . 0.49 ' O ' ' HB2' ' A' ' 35' ' ' TYR . 3.4 m -57.19 -38.66 73.98 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 121.091 -1.006 . . . . 0.0 109.81 179.966 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . -72.92 -36.52 57.36 Favored Glycine 0 N--CA 1.493 2.437 0 N-CA-C 109.621 -1.392 . . . . 0.0 109.621 -179.991 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' LEU . . . . . 0.507 ' O ' HD13 ' A' ' 37' ' ' LEU . 81.0 mt -73.15 -66.22 0.71 Allowed 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.432 -1.04 . . . . 0.0 110.09 -179.851 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . 0.464 ' O ' ' HB2' ' A' ' 37' ' ' LEU . 80.2 t80 -46.34 -34.46 4.58 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.357 -0.839 . . . . 0.0 109.173 179.655 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' TYR . . . . . 0.632 ' O ' ' N ' ' A' ' 39' ' ' GLN . 30.5 t80 -63.47 -62.58 1.58 Allowed 'General case' 0 C--O 1.193 -1.886 0 O-C-N 121.285 -0.885 . . . . 0.0 109.009 178.746 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 1.4 tttm -48.06 -30.41 4.41 Favored 'General case' 0 N--CA 1.506 2.363 0 O-C-N 120.084 -1.635 . . . . 0.0 110.799 179.916 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.606 HD23 ' P ' ' C' ' 122' ' ' ' DT' . 9.6 mp -57.33 -69.52 0.16 Allowed 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.198 -0.939 . . . . 0.0 109.971 179.734 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' HIS . . . . . 0.543 ' HB2' HG22 ' A' ' 40' ' ' VAL . 17.6 m-70 -99.38 -28.74 13.14 Favored 'General case' 0 N--CA 1.506 2.34 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 179.039 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.632 ' N ' ' O ' ' A' ' 35' ' ' TYR . 0.9 OUTLIER 76.19 49.0 0.07 Allowed 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 122.059 0.933 . . . . 0.0 110.346 179.21 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' VAL . . . . . 0.543 HG22 ' HB2' ' A' ' 38' ' ' HIS . 2.8 m -133.44 -178.87 2.9 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.452 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 178.558 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 1.1 p-10 -59.1 161.05 5.53 Favored 'General case' 0 N--CA 1.502 2.174 0 O-C-N 120.641 -1.287 . . . . 0.0 110.022 179.779 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' ARG . . . . . 0.499 ' N ' ' CD ' ' A' ' 42' ' ' ARG . 0.0 OUTLIER -127.21 106.69 21.69 Favored Pre-proline 0 N--CA 1.498 1.962 0 O-C-N 121.041 -1.037 . . . . 0.0 109.759 -179.12 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -62.16 141.93 90.08 Favored 'Trans proline' 0 C--N 1.318 -1.051 0 C-N-CA 122.353 2.035 . . . . 0.0 110.96 -179.902 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' LEU . . . . . 0.643 ' O ' HD12 ' A' ' 44' ' ' LEU . 0.6 OUTLIER -84.8 5.52 28.3 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.257 -0.902 . . . . 0.0 110.785 179.953 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . . . . . . . . . 54.6 p -61.24 -26.7 67.93 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 120.461 -1.399 . . . . 0.0 109.696 179.054 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -84.65 4.19 33.57 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.133 -0.979 . . . . 0.0 110.821 179.79 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' ARG . . . . . 0.623 ' HD2' ' SG ' ' A' ' 10' ' ' CYS . 0.7 OUTLIER -82.35 -174.9 5.41 Favored 'General case' 0 N--CA 1.5 2.072 0 O-C-N 120.567 -1.333 . . . . 0.0 109.621 179.636 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 10.0 tptp -151.43 156.9 41.59 Favored 'General case' 0 N--CA 1.494 1.742 0 O-C-N 121.124 -0.985 . . . . 0.0 109.416 179.793 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' ASP . . . . . . . . . . . . . 2.2 p-10 -55.03 -35.2 64.19 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 121.295 -0.878 . . . . 0.0 109.792 179.878 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' GLY . . . . . . . . . . . . . . . -126.88 146.92 16.63 Favored Glycine 0 N--CA 1.496 2.661 0 N-CA-C 109.071 -1.612 . . . . 0.0 109.071 179.033 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' ILE . . . . . 0.513 HG13 ' HB ' ' A' ' 14' ' ' THR . 6.0 mt -50.22 120.62 1.16 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.946 0 O-C-N 121.345 -1.091 . . . . 0.0 109.852 -179.906 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.79 151.57 33.81 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.404 -0.81 . . . . 0.0 109.563 179.814 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' THR . . . . . 0.431 ' O ' ' HG2' ' A' ' 54' ' ' ARG . 0.0 OUTLIER -155.49 165.04 37.82 Favored 'General case' 0 N--CA 1.5 2.036 0 O-C-N 121.266 -0.896 . . . . 0.0 109.419 179.445 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' ARG . . . . . 0.482 ' NH1' ' HG3' ' A' ' 54' ' ' ARG . 2.1 mtm-85 -145.64 -152.49 0.43 Allowed 'General case' 0 N--CA 1.499 1.977 0 O-C-N 121.625 -0.672 . . . . 0.0 109.709 -179.5 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -62.58 122.56 16.12 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.112 -0.993 . . . . 0.0 109.105 179.324 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -45.06 112.82 0.48 Allowed 'General case' 0 N--CA 1.5 2.059 0 CA-C-O 121.446 0.641 . . . . 0.0 110.752 -179.171 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.19 112.21 7.15 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.389 -0.819 . . . . 0.0 109.287 179.873 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 7.9 p -80.09 149.1 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.563 0 O-C-N 121.192 -0.942 . . . . 0.0 108.917 179.604 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 0.3 OUTLIER -59.68 139.45 57.22 Favored 'General case' 0 N--CA 1.498 1.94 0 O-C-N 121.083 -1.011 . . . . 0.0 109.732 -179.576 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' SER . . . . . . . . . . . . . 9.0 t . . . . . 0 N--CA 1.494 1.733 0 O-C-N 121.35 -0.844 . . . . 0.0 110.492 -179.739 . . . . . . . . 0 0 . 1 stop_ save_