data_1szv_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 1szv _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.447 ' CG ' ' HG ' ' A' ' 115' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.17 0.51 . . . . 0.0 110.387 . . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.45 -5.69 4.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.109 -0.994 . . . . 0.0 111.327 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ARG . . . . . 0.475 ' CB ' ' HD3' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -91.76 -61.45 0.2 Allowed Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 120.786 -1.196 . . . . 0.0 111.158 -179.057 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PRO . . . . . 0.475 ' HD3' ' CB ' ' A' ' 3' ' ' ARG . 88.7 Cg_endo -79.81 -163.23 0.21 Allowed 'Trans proline' 0 C--N 1.313 -1.299 0 O-C-N 123.195 1.103 . . . . 0.0 110.445 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -84.68 51.86 2.24 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.203 -0.936 . . . . 0.0 109.591 177.963 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.415 ' HA ' ' HB3' ' A' ' 1' ' ' MET . . . 60.27 152.85 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.168 -0.958 . . . . 0.0 109.967 -178.502 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 20.5 tp -71.16 -89.66 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.05 -1.031 . . . . 0.0 110.411 -179.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' THR . . . . . . . . . . . . . 21.8 p -96.22 -15.24 22.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.844 -1.16 . . . . 0.0 110.706 179.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' GLN . . . . . . . . . . . . . 25.1 mm100 -50.54 -68.97 0.13 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.107 -0.996 . . . . 0.0 110.975 -179.474 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' VAL . . . . . 0.421 ' O ' ' N ' ' A' ' 14' ' ' ALA . 61.2 t -69.77 -21.06 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.299 -0.876 . . . . 0.0 110.807 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' LEU . . . . . 0.415 ' CD2' HD21 ' A' ' 24' ' ' LEU . 0.2 OUTLIER -68.76 -23.77 64.36 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.01 -1.056 . . . . 0.0 109.992 179.408 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.0 p -94.05 -48.54 6.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.337 -0.852 . . . . 0.0 110.326 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -82.24 -42.59 18.71 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 10' ' ' VAL . . . 45.07 65.31 1.13 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 121.188 0.518 . . . . 0.0 111.18 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . 0.406 ' HA ' ' O ' ' A' ' 19' ' ' VAL . 2.2 m-20 -170.47 -53.31 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.169 -0.957 . . . . 0.0 110.675 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.6 p -64.69 -49.96 68.88 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.0 110.529 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -54.19 -94.42 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -159.85 39.04 0.47 Allowed Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' VAL . . . . . 0.406 ' O ' ' HA ' ' A' ' 15' ' ' ASN . 2.4 t -141.61 -175.24 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.457 -1.025 . . . . 0.0 108.914 -179.192 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -133.69 -50.5 0.84 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.932 -1.105 . . . . 0.0 109.788 178.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' SER . . . . . 0.433 ' HB2' ' CB ' ' A' ' 35' ' ' SER . 0.0 OUTLIER -126.7 160.13 31.66 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.417 -0.802 . . . . 0.0 109.856 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' THR . . . . . . . . . . . . . 0.1 OUTLIER -139.98 131.17 26.51 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.103 -0.998 . . . . 0.0 110.694 179.795 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.464 ' CD1' ' CB ' ' A' ' 33' ' ' ALA . 0.5 OUTLIER -124.76 120.72 32.59 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.587 -0.695 . . . . 0.0 109.31 179.502 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LEU . . . . . 0.415 HD21 ' CD2' ' A' ' 11' ' ' LEU . 1.1 mm? -113.67 129.02 56.64 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.902 -1.123 . . . . 0.0 110.652 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.455 ' CD2' ' N ' ' A' ' 25' ' ' LEU . 1.6 mt -109.16 112.93 25.37 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.426 -0.796 . . . . 0.0 109.413 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASN . . . . . 0.438 ' HA ' ' CD1' ' A' ' 89' ' ' LEU . 6.0 m-20 -90.04 161.56 15.77 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.279 -0.888 . . . . 0.0 111.479 -177.368 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 32.9 t-20 54.37 21.54 3.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.602 -0.686 . . . . 0.0 110.591 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 49.67 67.85 0.83 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.141 -0.974 . . . . 0.0 109.997 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 155.29 -55.41 0.41 Allowed Glycine 0 N--CA 1.488 2.162 0 N-CA-C 108.891 -1.684 . . . . 0.0 108.891 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' SER . . . . . . . . . . . . . 1.2 t -59.62 135.55 57.71 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.169 -1.195 . . . . 0.0 109.306 178.239 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' LEU . . . . . 0.403 ' CD1' HD11 ' A' ' 23' ' ' LEU . 1.3 tp -119.44 111.42 18.12 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.116 -0.99 . . . . 0.0 111.468 -177.872 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LEU . . . . . . . . . . . . . 1.4 mp -121.91 116.86 25.13 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 173.462 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ALA . . . . . 0.464 ' CB ' ' CD1' ' A' ' 23' ' ' LEU . . . -134.28 170.42 15.73 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 120.922 -1.111 . . . . 0.0 112.862 -177.206 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -138.78 101.09 4.23 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 175.101 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' SER . . . . . 0.433 ' CB ' ' HB2' ' A' ' 21' ' ' SER . 5.2 p -169.51 -164.49 0.45 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.979 -1.076 . . . . 0.0 111.505 -176.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' GLY . . . . . 0.425 ' O ' ' HB3' ' A' ' 37' ' ' TYR . . . -49.61 -81.05 0.05 OUTLIER Glycine 0 N--CA 1.493 2.45 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TYR . . . . . 0.443 ' CG ' ' O ' ' A' ' 37' ' ' TYR . 21.0 t80 58.97 20.6 8.35 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.427 -1.043 . . . . 0.0 110.839 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 142.42 36.46 0.09 OUTLIER Glycine 0 N--CA 1.493 2.464 0 C-N-CA 119.525 -1.322 . . . . 0.0 110.953 178.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 16.9 p-10 -176.72 -41.58 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.986 -1.302 . . . . 0.0 110.716 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.36 -66.32 0.91 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.154 -0.966 . . . . 0.0 110.264 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.424 ' CG ' ' CE2' ' A' ' 94' ' ' TYR . 5.4 t0 -104.18 -19.56 14.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.246 -0.909 . . . . 0.0 110.472 179.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ALA . . . . . . . . . . . . . . . 54.25 28.3 9.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.128 -0.983 . . . . 0.0 108.778 -176.554 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' ARG . . . . . 0.407 ' NH2' HG21 ' A' ' 81' ' ' VAL . 49.0 mtp180 -57.89 -16.51 12.19 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.638 -0.664 . . . . 0.0 111.069 -178.025 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' VAL . . . . . 0.417 ' O ' ' N ' ' A' ' 46' ' ' ALA . 14.4 t 59.54 51.17 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -174.287 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' THR . . . . . 0.444 ' HA ' ' CG2' ' A' ' 48' ' ' ILE . 41.3 p -33.12 -34.21 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.678 -176.485 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.34 -66.48 0.68 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.98 -1.075 . . . . 0.0 110.369 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' ALA . . . . . . . . . . . . . . . -57.91 -42.15 84.14 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.432 -0.793 . . . . 0.0 110.62 -179.652 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ILE . . . . . 0.444 ' CG2' ' HA ' ' A' ' 45' ' ' THR . 2.3 tt -70.26 -24.82 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.078 -1.014 . . . . 0.0 110.656 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ALA . . . . . 0.419 ' CB ' ' O ' ' A' ' 45' ' ' THR . . . -67.49 -57.37 6.65 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.995 -1.066 . . . . 0.0 109.616 -179.666 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -58.29 -38.84 77.81 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.431 -0.793 . . . . 0.0 109.753 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.443 ' O ' ' CB ' ' A' ' 55' ' ' ALA . 2.8 m-20 -73.67 -26.89 60.96 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.322 -0.861 . . . . 0.0 110.133 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ILE . . . . . 0.435 HG22 ' N ' ' A' ' 53' ' ' TRP . 0.6 OUTLIER -60.63 -57.34 12.42 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.508 0 O-C-N 120.963 -1.086 . . . . 0.0 109.074 179.663 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' TRP . . . . . 0.528 ' CZ2' ' NH2' ' A' ' 85' ' ' ARG . 74.0 t-105 -63.88 -48.87 74.96 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.381 -0.825 . . . . 0.0 111.154 -178.878 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' ALA . . . . . 0.403 ' O ' ' HB2' ' A' ' 57' ' ' ASP . . . -74.38 -63.71 1.18 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.314 -0.867 . . . . 0.0 111.767 -177.056 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' ALA . . . . . 0.443 ' CB ' ' O ' ' A' ' 51' ' ' ASN . . . -48.7 -46.31 40.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.959 -1.088 . . . . 0.0 110.784 -178.42 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.499 ' CE2' ' HA ' ' A' ' 72' ' ' ILE . 87.4 t80 -69.73 -26.68 64.44 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 118.678 -1.209 . . . . 0.0 109.327 178.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ASP . . . . . 0.423 ' HB2' ' O ' ' A' ' 53' ' ' TRP . 1.0 OUTLIER -53.87 -51.61 63.11 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.172 -0.955 . . . . 0.0 110.017 178.244 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.85 -57.26 3.38 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.414 -0.804 . . . . 0.0 110.729 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -61.0 -39.74 90.83 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.25 -0.906 . . . . 0.0 110.701 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -94.1 -86.08 1.64 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -169.01 150.46 4.52 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.251 -1.146 . . . . 0.0 109.88 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -109.54 149.69 29.26 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.347 -0.846 . . . . 0.0 110.721 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . 0.427 ' C ' ' CD1' ' A' ' 64' ' ' PHE . . . -117.57 -170.87 1.94 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.399 -0.813 . . . . 0.0 110.036 179.32 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' PHE . . . . . 0.427 ' CD1' ' C ' ' A' ' 63' ' ' ALA . 80.3 m-85 -147.53 -82.08 0.13 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.115 -0.991 . . . . 0.0 110.536 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -120.06 110.7 16.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.111 -0.993 . . . . 0.0 110.67 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -161.57 -45.94 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.266 -0.896 . . . . 0.0 110.29 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 52.39 23.14 2.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.241 -0.912 . . . . 0.0 110.574 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 18.0 m -161.41 24.48 0.13 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.182 -0.948 . . . . 0.0 110.507 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' LEU . . . . . 0.431 ' O ' ' CD2' ' A' ' 69' ' ' LEU . 0.4 OUTLIER -169.65 24.44 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.161 -0.962 . . . . 0.0 111.4 -179.346 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' LYS . . . . . 0.453 ' CB ' ' HB3' ' A' ' 85' ' ' ARG . 4.0 mttt -88.86 68.54 8.48 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 120.935 -1.103 . . . . 0.0 109.814 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' PHE . . . . . 0.487 ' CZ ' HD13 ' A' ' 73' ' ' LEU . 18.8 t80 -83.76 120.78 26.44 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.093 -1.005 . . . . 0.0 110.765 -178.293 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' ILE . . . . . 0.499 ' HA ' ' CE2' ' A' ' 56' ' ' TYR . 2.2 mp -123.26 142.96 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.705 -0.622 . . . . 0.0 109.742 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' LEU . . . . . 0.487 HD13 ' CZ ' ' A' ' 71' ' ' PHE . 1.6 mp -136.0 143.7 44.92 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.879 -1.138 . . . . 0.0 111.174 -177.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' MET . . . . . 0.432 ' HE3' ' CG1' ' A' ' 52' ' ' ILE . 0.0 OUTLIER -160.43 166.06 29.93 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.365 -0.834 . . . . 0.0 110.237 178.969 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ASP . . . . . 0.403 ' CB ' ' HG2' ' A' ' 80' ' ' ARG . 3.1 p30 -127.54 165.84 19.12 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.132 -0.98 . . . . 0.0 110.557 -179.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.23 -61.97 0.59 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.282 -0.886 . . . . 0.0 110.1 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -159.84 130.22 5.6 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.345 -0.847 . . . . 0.0 109.985 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 52.6 92.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.131 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 88.98 -166.05 33.52 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.103 -1.599 . . . . 0.0 109.103 -179.305 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ARG . . . . . 0.403 ' HG2' ' CB ' ' A' ' 75' ' ' ASP . 69.3 mtm180 -149.68 174.25 12.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.035 -1.274 . . . . 0.0 110.442 179.816 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' VAL . . . . . 0.407 HG21 ' NH2' ' A' ' 43' ' ' ARG . 13.4 p -113.7 144.69 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 O-C-N 121.257 -0.902 . . . . 0.0 110.676 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' ALA . . . . . 0.403 ' HB2' ' CG2' ' A' ' 99' ' ' VAL . . . -106.45 110.85 23.18 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.358 -0.839 . . . . 0.0 109.753 178.785 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' ILE . . . . . 0.4 HG12 ' CG2' ' A' ' 52' ' ' ILE . 1.4 mt -99.41 145.19 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.466 -0.771 . . . . 0.0 109.627 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' THR . . . . . . . . . . . . . 1.8 t -158.34 121.94 3.96 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.697 -1.252 . . . . 0.0 111.213 178.053 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' ARG . . . . . 0.528 ' NH2' ' CZ2' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -97.8 120.98 39.15 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.331 -0.856 . . . . 0.0 109.976 179.114 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 5.5 p -148.91 143.58 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.414 -0.804 . . . . 0.0 110.397 -179.591 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' ALA . . . . . 0.439 ' O ' ' CD1' ' A' ' 119' ' ' LEU . . . 55.42 39.62 31.18 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.142 -0.974 . . . . 0.0 110.59 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 54.1 t30 61.17 11.89 3.77 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.07 -1.019 . . . . 0.0 110.715 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' LEU . . . . . 0.438 ' CD1' ' HA ' ' A' ' 26' ' ' ASN . 39.2 tp -132.1 133.86 44.8 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.119 -0.988 . . . . 0.0 108.84 178.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' LEU . . . . . 0.471 ' CD1' ' CD ' ' A' ' 85' ' ' ARG . 1.0 OUTLIER -106.61 136.69 45.97 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 120.966 -1.083 . . . . 0.0 111.634 -178.387 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' LEU . . . . . 0.417 HD23 ' N ' ' A' ' 92' ' ' CYS . 4.1 tt -111.06 121.23 44.81 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 176.22 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' CYS . . . . . 0.421 ' HB3' ' O ' ' A' ' 23' ' ' LEU . 44.8 t -121.34 149.79 42.42 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' MET . . . . . . . . . . . . . 11.9 ptp -158.67 145.14 17.13 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.732 -1.23 . . . . 0.0 111.938 -178.178 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' TYR . . . . . 0.424 ' CE2' ' CG ' ' A' ' 41' ' ' ASP . 1.1 t80 -91.74 118.41 30.65 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 174.932 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' ALA . . . . . . . . . . . . . . . -150.14 173.21 14.16 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.353 -0.842 . . . . 0.0 110.212 -177.673 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -112.84 -34.19 5.85 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.303 -0.873 . . . . 0.0 109.937 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -119.16 -38.37 3.05 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.443 -0.786 . . . . 0.0 110.114 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' THR . . . . . . . . . . . . . 27.9 m -53.33 -27.07 21.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.288 -0.882 . . . . 0.0 110.11 179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' VAL . . . . . 0.403 ' CG2' ' HB2' ' A' ' 82' ' ' ALA . 78.9 t -77.05 70.73 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.301 -0.875 . . . . 0.0 110.032 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -63.38 -145.97 0.02 OUTLIER Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.69 -75.0 0.24 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.182 -1.187 . . . . 0.0 110.484 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -89.12 -59.11 1.6 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.276 -1.53 . . . . 0.0 109.276 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' MET . . . . . 0.415 ' HE2' ' N ' ' A' ' 104' ' ' LEU . 0.1 OUTLIER -52.22 -34.13 44.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.281 -1.129 . . . . 0.0 110.241 179.382 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . 0.481 ' HB3' ' CZ ' ' A' ' 71' ' ' PHE . 0.2 OUTLIER -62.69 -33.24 74.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.251 -0.905 . . . . 0.0 110.548 -179.698 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' LYS . . . . . 0.479 ' HG2' ' CG ' ' A' ' 71' ' ' PHE . 2.8 mtmm -54.63 -65.83 0.51 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.242 -0.911 . . . . 0.0 110.122 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.24 -30.69 66.73 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.287 -0.883 . . . . 0.0 109.894 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 107' ' ' LYS . . . . . . . . . . . . . 4.5 tttp -62.53 -36.76 83.64 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.323 -0.861 . . . . 0.0 109.982 179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -69.38 -55.49 10.23 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.345 -0.847 . . . . 0.0 110.073 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 109' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -50.45 -44.93 55.71 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.139 -0.976 . . . . 0.0 109.749 178.781 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.07 -40.67 95.02 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.389 -0.819 . . . . 0.0 109.164 177.384 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 111' ' ' LEU . . . . . 0.428 HD23 ' CD2' ' A' ' 115' ' ' LEU . 0.8 OUTLIER -48.17 -30.34 4.53 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.372 -0.83 . . . . 0.0 110.243 178.75 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 112' ' ' VAL . . . . . 0.422 ' O ' ' CD ' ' A' ' 118' ' ' PRO . 75.9 t -83.03 -46.64 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 121.525 -0.734 . . . . 0.0 110.611 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.5 tm0? -85.58 -37.44 19.57 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.194 -0.941 . . . . 0.0 112.016 -176.912 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -72.24 -63.61 1.11 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.882 -1.136 . . . . 0.0 111.309 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 115' ' ' LEU . . . . . 0.447 ' HG ' ' CG ' ' A' ' 1' ' ' MET . 8.3 mp -48.27 -77.93 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.027 -1.046 . . . . 0.0 110.785 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 116' ' ' GLU . . . . . 0.432 ' C ' ' HD3' ' A' ' 118' ' ' PRO . 3.1 tt0 -97.21 -156.33 0.53 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.175 -0.953 . . . . 0.0 109.915 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 117' ' ' GLU . . . . . 0.499 ' N ' ' HD3' ' A' ' 118' ' ' PRO . 24.9 tt0 -138.74 62.53 28.56 Favored Pre-proline 0 C--N 1.298 -1.641 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 173.429 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 118' ' ' PRO . . . . . 0.499 ' HD3' ' N ' ' A' ' 117' ' ' GLU . 53.7 Cg_endo -112.09 -172.58 0.03 OUTLIER 'Trans proline' 0 C--N 1.317 -1.131 0 C-N-CA 121.528 1.486 . . . . 0.0 110.73 -173.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 119' ' ' LEU . . . . . 0.439 ' CD1' ' O ' ' A' ' 87' ' ' ALA . 4.4 mm? 61.76 -60.0 0.11 Allowed 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 177.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 120' ' ' THR . . . . . 0.459 ' N ' ' O ' ' A' ' 118' ' ' PRO . 80.6 p -44.79 -28.93 0.7 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.153 -0.967 . . . . 0.0 111.363 -178.222 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 121' ' ' GLN . . . . . 0.458 ' O ' ' CG1' ' A' ' 122' ' ' VAL . 32.1 mt-30 -65.07 124.83 23.11 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.095 -1.003 . . . . 0.0 109.529 178.338 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 122' ' ' VAL . . . . . 0.458 ' CG1' ' O ' ' A' ' 121' ' ' GLN . 14.7 p 38.27 48.17 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.273 0 CA-C-O 121.4 0.619 . . . . 0.0 111.524 -178.811 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 123' ' ' ALA . . . . . . . . . . . . . . . -168.61 -37.05 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.312 -0.867 . . . . 0.0 110.527 -179.653 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 124' ' ' ALA . . . . . . . . . . . . . . . 57.76 95.93 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.257 -0.902 . . . . 0.0 110.398 -179.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 125' ' ' SER . . . . . . . . . . . . . 71.1 p . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 118.018 -0.991 . . . . 0.0 110.347 179.968 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.459 ' CG ' ' HG ' ' A' ' 115' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.17 0.51 . . . . 0.0 110.387 . . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.45 -5.69 4.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.109 -0.994 . . . . 0.0 111.327 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ARG . . . . . 0.495 ' CB ' ' HD3' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -91.76 -61.45 0.2 Allowed Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 120.786 -1.196 . . . . 0.0 111.158 -179.057 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PRO . . . . . 0.495 ' HD3' ' CB ' ' A' ' 3' ' ' ARG . 88.7 Cg_endo -79.81 -163.23 0.21 Allowed 'Trans proline' 0 C--N 1.313 -1.299 0 O-C-N 123.195 1.103 . . . . 0.0 110.445 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -84.68 51.86 2.24 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.203 -0.936 . . . . 0.0 109.591 177.963 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.712 ' HB1' ' HB2' ' A' ' 9' ' ' GLN . . . 60.27 152.85 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.168 -0.958 . . . . 0.0 109.967 -178.502 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . 0.689 ' HB2' HD23 ' A' ' 115' ' ' LEU . 20.5 tp -71.16 -89.66 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.05 -1.031 . . . . 0.0 110.411 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' THR . . . . . 0.582 HG23 ' HG ' ' A' ' 7' ' ' LEU . 21.8 p -96.22 -15.24 22.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.844 -1.16 . . . . 0.0 110.706 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' GLN . . . . . 0.712 ' HB2' ' HB1' ' A' ' 6' ' ' ALA . 25.1 mm100 -50.54 -68.97 0.13 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.107 -0.996 . . . . 0.0 110.975 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' VAL . . . . . 0.544 HG23 ' HB3' ' A' ' 6' ' ' ALA . 61.2 t -69.77 -21.06 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.299 -0.876 . . . . 0.0 110.807 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' LEU . . . . . 0.891 ' HA ' HG21 ' A' ' 22' ' ' THR . 0.2 OUTLIER -68.76 -23.77 64.36 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.01 -1.056 . . . . 0.0 109.992 179.408 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.0 p -94.05 -48.54 6.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.337 -0.852 . . . . 0.0 110.326 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -82.24 -42.59 18.71 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 10' ' ' VAL . . . 45.07 65.31 1.13 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 121.188 0.518 . . . . 0.0 111.18 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . 0.412 ' HA ' ' O ' ' A' ' 19' ' ' VAL . 2.2 m-20 -170.47 -53.31 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.169 -0.957 . . . . 0.0 110.675 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.6 p -64.69 -49.96 68.88 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.0 110.529 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -54.19 -94.42 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -159.85 39.04 0.47 Allowed Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' VAL . . . . . 0.715 HG13 ' HB2' ' A' ' 95' ' ' ALA . 2.4 t -141.61 -175.24 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.457 -1.025 . . . . 0.0 108.914 -179.192 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' GLN . . . . . 0.614 ' H ' HG12 ' A' ' 19' ' ' VAL . 0.3 OUTLIER -133.69 -50.5 0.84 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.932 -1.105 . . . . 0.0 109.788 178.623 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 21' ' ' SER . . . . . 0.43 ' OG ' ' CB ' ' A' ' 35' ' ' SER . 0.0 OUTLIER -126.7 160.13 31.66 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.417 -0.802 . . . . 0.0 109.856 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 22' ' ' THR . . . . . 0.891 HG21 ' HA ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -139.98 131.17 26.51 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.103 -0.998 . . . . 0.0 110.694 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.941 ' CD2' HD21 ' A' ' 25' ' ' LEU . 0.5 OUTLIER -124.76 120.72 32.59 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.587 -0.695 . . . . 0.0 109.31 179.502 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LEU . . . . . 0.833 ' C ' HD23 ' A' ' 25' ' ' LEU . 1.1 mm? -113.67 129.02 56.64 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.902 -1.123 . . . . 0.0 110.652 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.941 HD21 ' CD2' ' A' ' 23' ' ' LEU . 1.6 mt -109.16 112.93 25.37 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.426 -0.796 . . . . 0.0 109.413 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASN . . . . . 0.424 ' HA ' ' CD1' ' A' ' 89' ' ' LEU . 6.0 m-20 -90.04 161.56 15.77 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.279 -0.888 . . . . 0.0 111.479 -177.368 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 32.9 t-20 54.37 21.54 3.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.602 -0.686 . . . . 0.0 110.591 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 49.67 67.85 0.83 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.141 -0.974 . . . . 0.0 109.997 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 155.29 -55.41 0.41 Allowed Glycine 0 N--CA 1.488 2.162 0 N-CA-C 108.891 -1.684 . . . . 0.0 108.891 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' SER . . . . . 0.426 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 1.2 t -59.62 135.55 57.71 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.169 -1.195 . . . . 0.0 109.306 178.239 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' LEU . . . . . 0.736 HD13 HD22 ' A' ' 25' ' ' LEU . 1.3 tp -119.44 111.42 18.12 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.116 -0.99 . . . . 0.0 111.468 -177.872 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LEU . . . . . 0.437 ' N ' HD12 ' A' ' 31' ' ' LEU . 1.4 mp -121.91 116.86 25.13 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 173.462 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ALA . . . . . 0.845 ' CB ' HD12 ' A' ' 23' ' ' LEU . . . -134.28 170.42 15.73 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 120.922 -1.111 . . . . 0.0 112.862 -177.206 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -138.78 101.09 4.23 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 175.101 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' SER . . . . . 0.43 ' CB ' ' OG ' ' A' ' 21' ' ' SER . 5.2 p -169.51 -164.49 0.45 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.979 -1.076 . . . . 0.0 111.505 -176.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' A' ' 37' ' ' TYR . . . -49.61 -81.05 0.05 OUTLIER Glycine 0 N--CA 1.493 2.45 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TYR . . . . . 0.443 ' CG ' ' O ' ' A' ' 37' ' ' TYR . 21.0 t80 58.97 20.6 8.35 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.427 -1.043 . . . . 0.0 110.839 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 142.42 36.46 0.09 OUTLIER Glycine 0 N--CA 1.493 2.464 0 C-N-CA 119.525 -1.322 . . . . 0.0 110.953 178.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 16.9 p-10 -176.72 -41.58 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.986 -1.302 . . . . 0.0 110.716 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.36 -66.32 0.91 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.154 -0.966 . . . . 0.0 110.264 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.424 ' CG ' ' CE2' ' A' ' 94' ' ' TYR . 5.4 t0 -104.18 -19.56 14.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.246 -0.909 . . . . 0.0 110.472 179.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ALA . . . . . 0.542 ' O ' HG23 ' A' ' 44' ' ' VAL . . . 54.25 28.3 9.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.128 -0.983 . . . . 0.0 108.778 -176.554 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' ARG . . . . . 0.491 ' NH2' HG21 ' A' ' 81' ' ' VAL . 49.0 mtp180 -57.89 -16.51 12.19 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.638 -0.664 . . . . 0.0 111.069 -178.025 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' VAL . . . . . 0.913 ' O ' HG22 ' A' ' 48' ' ' ILE . 14.4 t 59.54 51.17 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -174.287 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' THR . . . . . 0.733 ' O ' ' HB2' ' A' ' 49' ' ' ALA . 41.3 p -33.12 -34.21 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.678 -176.485 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.34 -66.48 0.68 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.98 -1.075 . . . . 0.0 110.369 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' ALA . . . . . 0.614 ' HB3' ' CG1' ' A' ' 44' ' ' VAL . . . -57.91 -42.15 84.14 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.432 -0.793 . . . . 0.0 110.62 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ILE . . . . . 0.913 HG22 ' O ' ' A' ' 44' ' ' VAL . 2.3 tt -70.26 -24.82 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.078 -1.014 . . . . 0.0 110.656 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ALA . . . . . 0.733 ' HB2' ' O ' ' A' ' 45' ' ' THR . . . -67.49 -57.37 6.65 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.995 -1.066 . . . . 0.0 109.616 -179.666 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -58.29 -38.84 77.81 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.431 -0.793 . . . . 0.0 109.753 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.719 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 2.8 m-20 -73.67 -26.89 60.96 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.322 -0.861 . . . . 0.0 110.133 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ILE . . . . . 0.639 HD13 HG12 ' A' ' 83' ' ' ILE . 0.6 OUTLIER -60.63 -57.34 12.42 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.508 0 O-C-N 120.963 -1.086 . . . . 0.0 109.074 179.663 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 53' ' ' TRP . . . . . 0.528 ' CZ2' ' NH2' ' A' ' 85' ' ' ARG . 74.0 t-105 -63.88 -48.87 74.96 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.381 -0.825 . . . . 0.0 111.154 -178.878 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 57' ' ' ASP . . . -74.38 -63.71 1.18 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.314 -0.867 . . . . 0.0 111.767 -177.056 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' ALA . . . . . 0.719 ' HB3' ' O ' ' A' ' 51' ' ' ASN . . . -48.7 -46.31 40.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.959 -1.088 . . . . 0.0 110.784 -178.42 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.94 ' CD2' HG23 ' A' ' 72' ' ' ILE . 87.4 t80 -69.73 -26.68 64.44 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 118.678 -1.209 . . . . 0.0 109.327 178.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 1.0 OUTLIER -53.87 -51.61 63.11 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.172 -0.955 . . . . 0.0 110.017 178.244 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.85 -57.26 3.38 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.414 -0.804 . . . . 0.0 110.729 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -61.0 -39.74 90.83 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.25 -0.906 . . . . 0.0 110.701 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -94.1 -86.08 1.64 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -169.01 150.46 4.52 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.251 -1.146 . . . . 0.0 109.88 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -109.54 149.69 29.26 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.347 -0.846 . . . . 0.0 110.721 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . 0.463 ' HB3' ' HE2' ' A' ' 70' ' ' LYS . . . -117.57 -170.87 1.94 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.399 -0.813 . . . . 0.0 110.036 179.32 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' PHE . . . . . 0.427 ' CD1' ' C ' ' A' ' 63' ' ' ALA . 80.3 m-85 -147.53 -82.08 0.13 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.115 -0.991 . . . . 0.0 110.536 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -120.06 110.7 16.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.111 -0.993 . . . . 0.0 110.67 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -161.57 -45.94 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.266 -0.896 . . . . 0.0 110.29 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 52.39 23.14 2.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.241 -0.912 . . . . 0.0 110.574 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.57 ' HA ' HG23 ' A' ' 86' ' ' VAL . 18.0 m -161.41 24.48 0.13 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.182 -0.948 . . . . 0.0 110.507 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' LEU . . . . . 0.431 ' O ' ' CD2' ' A' ' 69' ' ' LEU . 0.4 OUTLIER -169.65 24.44 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.161 -0.962 . . . . 0.0 111.4 -179.346 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 70' ' ' LYS . . . . . 0.631 ' O ' HD12 ' A' ' 72' ' ' ILE . 4.0 mttt -88.86 68.54 8.48 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 120.935 -1.103 . . . . 0.0 109.814 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' PHE . . . . . 0.495 ' CZ ' ' HB3' ' A' ' 104' ' ' LEU . 18.8 t80 -83.76 120.78 26.44 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.093 -1.005 . . . . 0.0 110.765 -178.293 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' ILE . . . . . 0.94 HG23 ' CD2' ' A' ' 56' ' ' TYR . 2.2 mp -123.26 142.96 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.705 -0.622 . . . . 0.0 109.742 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 73' ' ' LEU . . . . . 0.792 HD12 ' O ' ' A' ' 72' ' ' ILE . 1.6 mp -136.0 143.7 44.92 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.879 -1.138 . . . . 0.0 111.174 -177.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' MET . . . . . 0.536 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -160.43 166.06 29.93 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.365 -0.834 . . . . 0.0 110.237 178.969 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -127.54 165.84 19.12 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.132 -0.98 . . . . 0.0 110.557 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.23 -61.97 0.59 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.282 -0.886 . . . . 0.0 110.1 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -159.84 130.22 5.6 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.345 -0.847 . . . . 0.0 109.985 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 52.6 92.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.131 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 88.98 -166.05 33.52 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.103 -1.599 . . . . 0.0 109.103 -179.305 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -149.68 174.25 12.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.035 -1.274 . . . . 0.0 110.442 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' VAL . . . . . 0.536 HG12 ' O ' ' A' ' 74' ' ' MET . 13.4 p -113.7 144.69 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 O-C-N 121.257 -0.902 . . . . 0.0 110.676 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 82' ' ' ALA . . . . . 0.942 ' HB2' HG22 ' A' ' 99' ' ' VAL . . . -106.45 110.85 23.18 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.358 -0.839 . . . . 0.0 109.753 178.785 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' ILE . . . . . 0.764 HD13 HG22 ' A' ' 72' ' ' ILE . 1.4 mt -99.41 145.19 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.466 -0.771 . . . . 0.0 109.627 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 84' ' ' THR . . . . . 0.662 HG22 ' O ' ' A' ' 91' ' ' LEU . 1.8 t -158.34 121.94 3.96 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.697 -1.252 . . . . 0.0 111.213 178.053 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 85' ' ' ARG . . . . . 0.528 ' NH2' ' CZ2' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -97.8 120.98 39.15 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.331 -0.856 . . . . 0.0 109.976 179.114 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . 0.68 HG21 ' HA ' ' A' ' 109' ' ' GLN . 5.5 p -148.91 143.58 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.414 -0.804 . . . . 0.0 110.397 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 87' ' ' ALA . . . . . 0.683 ' HB1' HD12 ' A' ' 119' ' ' LEU . . . 55.42 39.62 31.18 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.142 -0.974 . . . . 0.0 110.59 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 54.1 t30 61.17 11.89 3.77 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.07 -1.019 . . . . 0.0 110.715 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 89' ' ' LEU . . . . . 0.424 ' CD1' ' HA ' ' A' ' 26' ' ' ASN . 39.2 tp -132.1 133.86 44.8 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.119 -0.988 . . . . 0.0 108.84 178.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' LEU . . . . . 0.617 HD22 HD12 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -106.61 136.69 45.97 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 120.966 -1.083 . . . . 0.0 111.634 -178.387 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 91' ' ' LEU . . . . . 0.662 ' O ' HG22 ' A' ' 84' ' ' THR . 4.1 tt -111.06 121.23 44.81 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 176.22 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' CYS . . . . . 0.596 ' HB3' HD23 ' A' ' 23' ' ' LEU . 44.8 t -121.34 149.79 42.42 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' MET . . . . . 0.427 ' O ' ' HA ' ' A' ' 81' ' ' VAL . 11.9 ptp -158.67 145.14 17.13 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.732 -1.23 . . . . 0.0 111.938 -178.178 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 94' ' ' TYR . . . . . 0.429 ' HB2' ' HD2' ' A' ' 43' ' ' ARG . 1.1 t80 -91.74 118.41 30.65 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 174.932 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' ALA . . . . . 1.07 ' HB3' HG23 ' A' ' 99' ' ' VAL . . . -150.14 173.21 14.16 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.353 -0.842 . . . . 0.0 110.212 -177.673 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -112.84 -34.19 5.85 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.303 -0.873 . . . . 0.0 109.937 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -119.16 -38.37 3.05 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.443 -0.786 . . . . 0.0 110.114 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' THR . . . . . 0.506 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 27.9 m -53.33 -27.07 21.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.288 -0.882 . . . . 0.0 110.11 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 99' ' ' VAL . . . . . 1.07 HG23 ' HB3' ' A' ' 95' ' ' ALA . 78.9 t -77.05 70.73 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.301 -0.875 . . . . 0.0 110.032 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -63.38 -145.97 0.02 OUTLIER Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.69 -75.0 0.24 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.182 -1.187 . . . . 0.0 110.484 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -89.12 -59.11 1.6 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.276 -1.53 . . . . 0.0 109.276 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 103' ' ' MET . . . . . 0.416 ' HE2' ' HB3' ' A' ' 103' ' ' MET . 0.1 OUTLIER -52.22 -34.13 44.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.281 -1.129 . . . . 0.0 110.241 179.382 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 71' ' ' PHE . 0.2 OUTLIER -62.69 -33.24 74.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.251 -0.905 . . . . 0.0 110.548 -179.698 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 105' ' ' LYS . . . . . 0.477 ' HG2' ' CG ' ' A' ' 71' ' ' PHE . 2.8 mtmm -54.63 -65.83 0.51 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.242 -0.911 . . . . 0.0 110.122 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.24 -30.69 66.73 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.287 -0.883 . . . . 0.0 109.894 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 107' ' ' LYS . . . . . 0.416 ' HD3' ' HE3' ' A' ' 103' ' ' MET . 4.5 tttp -62.53 -36.76 83.64 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.323 -0.861 . . . . 0.0 109.982 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -69.38 -55.49 10.23 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.345 -0.847 . . . . 0.0 110.073 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 109' ' ' GLN . . . . . 0.68 ' HA ' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -50.45 -44.93 55.71 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.139 -0.976 . . . . 0.0 109.749 178.781 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.07 -40.67 95.02 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.389 -0.819 . . . . 0.0 109.164 177.384 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 111' ' ' LEU . . . . . 0.634 HD23 HD22 ' A' ' 115' ' ' LEU . 0.8 OUTLIER -48.17 -30.34 4.53 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.372 -0.83 . . . . 0.0 110.243 178.75 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 112' ' ' VAL . . . . . 0.422 ' O ' ' CD ' ' A' ' 118' ' ' PRO . 75.9 t -83.03 -46.64 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 121.525 -0.734 . . . . 0.0 110.611 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.5 tm0? -85.58 -37.44 19.57 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.194 -0.941 . . . . 0.0 112.016 -176.912 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -72.24 -63.61 1.11 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.882 -1.136 . . . . 0.0 111.309 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 115' ' ' LEU . . . . . 0.689 HD23 ' HB2' ' A' ' 7' ' ' LEU . 8.3 mp -48.27 -77.93 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.027 -1.046 . . . . 0.0 110.785 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 116' ' ' GLU . . . . . 0.458 ' C ' ' HD3' ' A' ' 118' ' ' PRO . 3.1 tt0 -97.21 -156.33 0.53 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.175 -0.953 . . . . 0.0 109.915 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 117' ' ' GLU . . . . . 0.504 ' N ' ' HD3' ' A' ' 118' ' ' PRO . 24.9 tt0 -138.74 62.53 28.56 Favored Pre-proline 0 C--N 1.298 -1.641 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 173.429 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 118' ' ' PRO . . . . . 0.504 ' HD3' ' N ' ' A' ' 117' ' ' GLU . 53.7 Cg_endo -112.09 -172.58 0.03 OUTLIER 'Trans proline' 0 C--N 1.317 -1.131 0 C-N-CA 121.528 1.486 . . . . 0.0 110.73 -173.057 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 119' ' ' LEU . . . . . 0.924 ' O ' ' HB3' ' A' ' 123' ' ' ALA . 4.4 mm? 61.76 -60.0 0.11 Allowed 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 177.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 120' ' ' THR . . . . . 0.479 ' N ' ' O ' ' A' ' 118' ' ' PRO . 80.6 p -44.79 -28.93 0.7 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.153 -0.967 . . . . 0.0 111.363 -178.222 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 121' ' ' GLN . . . . . 0.539 ' C ' HG12 ' A' ' 122' ' ' VAL . 32.1 mt-30 -65.07 124.83 23.11 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.095 -1.003 . . . . 0.0 109.529 178.338 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 122' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 122' ' ' VAL . 14.7 p 38.27 48.17 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.273 0 CA-C-O 121.4 0.619 . . . . 0.0 111.524 -178.811 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 123' ' ' ALA . . . . . 0.924 ' HB3' ' O ' ' A' ' 119' ' ' LEU . . . -168.61 -37.05 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.312 -0.867 . . . . 0.0 110.527 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 124' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 123' ' ' ALA . . . 57.76 95.93 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.257 -0.902 . . . . 0.0 110.398 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 125' ' ' SER . . . . . 0.518 ' HB2' ' HB2' ' A' ' 87' ' ' ALA . 71.1 p . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 118.018 -0.991 . . . . 0.0 110.347 179.968 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.459 ' CG ' ' HG ' ' A' ' 115' ' ' LEU . 0.0 OUTLIER . . . . . 0 N--CA 1.49 1.547 0 CA-C-O 121.17 0.51 . . . . 0.0 110.387 . . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' LEU . . . . . . . . . . . . . 0.3 OUTLIER -130.45 -5.69 4.23 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.109 -0.994 . . . . 0.0 111.327 -179.415 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ARG . . . . . 0.495 ' CB ' ' HD3' ' A' ' 4' ' ' PRO . 0.0 OUTLIER -91.76 -61.45 0.2 Allowed Pre-proline 0 N--CA 1.493 1.679 0 O-C-N 120.786 -1.196 . . . . 0.0 111.158 -179.057 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PRO . . . . . 0.495 ' HD3' ' CB ' ' A' ' 3' ' ' ARG . 88.7 Cg_endo -79.81 -163.23 0.21 Allowed 'Trans proline' 0 C--N 1.313 -1.299 0 O-C-N 123.195 1.103 . . . . 0.0 110.445 -179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' LYS . . . . . 0.506 ' O ' ' HB3' ' A' ' 6' ' ' ALA . 0.0 OUTLIER -84.68 51.86 2.24 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.203 -0.936 . . . . 0.0 109.591 177.963 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.712 ' HB1' ' HB2' ' A' ' 9' ' ' GLN . . . 60.27 152.85 0.02 OUTLIER 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.168 -0.958 . . . . 0.0 109.967 -178.502 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . 0.689 ' HB2' HD23 ' A' ' 115' ' ' LEU . 20.5 tp -71.16 -89.66 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.05 -1.031 . . . . 0.0 110.411 -179.35 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' THR . . . . . 0.582 HG23 ' HG ' ' A' ' 7' ' ' LEU . 21.8 p -96.22 -15.24 22.13 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.844 -1.16 . . . . 0.0 110.706 179.875 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' GLN . . . . . 0.712 ' HB2' ' HB1' ' A' ' 6' ' ' ALA . 25.1 mm100 -50.54 -68.97 0.13 Allowed 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.107 -0.996 . . . . 0.0 110.975 -179.474 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' VAL . . . . . 0.544 HG23 ' HB3' ' A' ' 6' ' ' ALA . 61.2 t -69.77 -21.06 24.0 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.604 0 O-C-N 121.299 -0.876 . . . . 0.0 110.807 -178.72 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' LEU . . . . . 0.891 ' HA ' HG21 ' A' ' 22' ' ' THR . 0.2 OUTLIER -68.76 -23.77 64.36 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.01 -1.056 . . . . 0.0 109.992 179.408 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' SER . . . . . . . . . . . . . 2.0 p -94.05 -48.54 6.19 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.337 -0.852 . . . . 0.0 110.326 179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLN . . . . . . . . . . . . . 7.7 mt-30 -82.24 -42.59 18.71 Favored 'General case' 0 N--CA 1.496 1.833 0 N-CA-C 108.534 -0.913 . . . . 0.0 108.534 178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.421 ' N ' ' O ' ' A' ' 10' ' ' VAL . . . 45.07 65.31 1.13 Allowed 'General case' 0 N--CA 1.488 1.458 0 CA-C-O 121.188 0.518 . . . . 0.0 111.18 179.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.412 ' HA ' ' O ' ' A' ' 19' ' ' VAL . 2.2 m-20 -170.47 -53.31 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.169 -0.957 . . . . 0.0 110.675 179.89 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' THR . . . . . . . . . . . . . 25.6 p -64.69 -49.96 68.88 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.287 -0.883 . . . . 0.0 110.529 -179.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLY . . . . . . . . . . . . . . . -54.19 -94.42 0.01 OUTLIER Glycine 0 N--CA 1.491 2.32 0 N-CA-C 109.472 -1.451 . . . . 0.0 109.472 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -159.85 39.04 0.47 Allowed Glycine 0 N--CA 1.491 2.342 0 N-CA-C 109.173 -1.571 . . . . 0.0 109.173 179.856 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' VAL . . . . . 0.715 HG13 ' HB2' ' A' ' 95' ' ' ALA . 2.4 t -141.61 -175.24 0.81 Allowed 'Isoleucine or valine' 0 N--CA 1.494 1.759 0 O-C-N 121.457 -1.025 . . . . 0.0 108.914 -179.192 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' GLN . . . . . 0.614 ' H ' HG12 ' A' ' 19' ' ' VAL . 0.3 OUTLIER -133.69 -50.5 0.84 Allowed 'General case' 0 N--CA 1.488 1.463 0 O-C-N 120.932 -1.105 . . . . 0.0 109.788 178.623 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' SER . . . . . 0.43 ' OG ' ' CB ' ' A' ' 35' ' ' SER . 0.0 OUTLIER -126.7 160.13 31.66 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.417 -0.802 . . . . 0.0 109.856 179.378 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' THR . . . . . 0.891 HG21 ' HA ' ' A' ' 11' ' ' LEU . 0.1 OUTLIER -139.98 131.17 26.51 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.103 -0.998 . . . . 0.0 110.694 179.795 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.941 ' CD2' HD21 ' A' ' 25' ' ' LEU . 0.5 OUTLIER -124.76 120.72 32.59 Favored 'General case' 0 C--N 1.304 -1.4 0 O-C-N 121.587 -0.695 . . . . 0.0 109.31 179.502 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LEU . . . . . 0.833 ' C ' HD23 ' A' ' 25' ' ' LEU . 1.1 mm? -113.67 129.02 56.64 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.902 -1.123 . . . . 0.0 110.652 -178.393 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.941 HD21 ' CD2' ' A' ' 23' ' ' LEU . 1.6 mt -109.16 112.93 25.37 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.426 -0.796 . . . . 0.0 109.413 -179.722 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASN . . . . . 0.424 ' HA ' ' CD1' ' A' ' 89' ' ' LEU . 6.0 m-20 -90.04 161.56 15.77 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.279 -0.888 . . . . 0.0 111.479 -177.368 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ASN . . . . . . . . . . . . . 32.9 t-20 54.37 21.54 3.27 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.602 -0.686 . . . . 0.0 110.591 179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLU . . . . . . . . . . . . . 1.4 tm-20 49.67 67.85 0.83 Allowed 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.141 -0.974 . . . . 0.0 109.997 -179.449 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLY . . . . . . . . . . . . . . . 155.29 -55.41 0.41 Allowed Glycine 0 N--CA 1.488 2.162 0 N-CA-C 108.891 -1.684 . . . . 0.0 108.891 -178.551 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' SER . . . . . 0.426 ' O ' ' HA ' ' A' ' 25' ' ' LEU . 1.2 t -59.62 135.55 57.71 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.169 -1.195 . . . . 0.0 109.306 178.239 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' LEU . . . . . 0.736 HD13 HD22 ' A' ' 25' ' ' LEU . 1.3 tp -119.44 111.42 18.12 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.116 -0.99 . . . . 0.0 111.468 -177.872 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LEU . . . . . 0.437 ' N ' HD12 ' A' ' 31' ' ' LEU . 1.4 mp -121.91 116.86 25.13 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 107.573 -1.269 . . . . 0.0 107.573 173.462 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ALA . . . . . 0.845 ' CB ' HD12 ' A' ' 23' ' ' LEU . . . -134.28 170.42 15.73 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 120.922 -1.111 . . . . 0.0 112.862 -177.206 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TYR . . . . . . . . . . . . . 1.7 t80 -138.78 101.09 4.23 Favored 'General case' 0 C--N 1.303 -1.437 0 N-CA-C 108.121 -1.066 . . . . 0.0 108.121 175.101 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' SER . . . . . 0.43 ' CB ' ' OG ' ' A' ' 21' ' ' SER . 5.2 p -169.51 -164.49 0.45 Allowed 'General case' 0 N--CA 1.489 1.49 0 O-C-N 120.979 -1.076 . . . . 0.0 111.505 -176.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' GLY . . . . . 0.433 ' O ' ' HB3' ' A' ' 37' ' ' TYR . . . -49.61 -81.05 0.05 OUTLIER Glycine 0 N--CA 1.493 2.45 0 N-CA-C 110.357 -1.097 . . . . 0.0 110.357 -179.31 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TYR . . . . . 0.443 ' CG ' ' O ' ' A' ' 37' ' ' TYR . 21.0 t80 58.97 20.6 8.35 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 121.427 -1.043 . . . . 0.0 110.839 -179.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLY . . . . . . . . . . . . . . . 142.42 36.46 0.09 OUTLIER Glycine 0 N--CA 1.493 2.464 0 C-N-CA 119.525 -1.322 . . . . 0.0 110.953 178.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASP . . . . . 0.417 ' OD1' ' N ' ' A' ' 39' ' ' ASP . 16.9 p-10 -176.72 -41.58 0.01 OUTLIER 'General case' 0 N--CA 1.496 1.83 0 O-C-N 120.986 -1.302 . . . . 0.0 110.716 178.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -98.36 -66.32 0.91 Allowed 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.154 -0.966 . . . . 0.0 110.264 -179.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.424 ' CG ' ' CE2' ' A' ' 94' ' ' TYR . 5.4 t0 -104.18 -19.56 14.1 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.246 -0.909 . . . . 0.0 110.472 179.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ALA . . . . . 0.542 ' O ' HG23 ' A' ' 44' ' ' VAL . . . 54.25 28.3 9.01 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.128 -0.983 . . . . 0.0 108.778 -176.554 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' ARG . . . . . 0.491 ' NH2' HG21 ' A' ' 81' ' ' VAL . 49.0 mtp180 -57.89 -16.51 12.19 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.638 -0.664 . . . . 0.0 111.069 -178.025 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' VAL . . . . . 0.913 ' O ' HG22 ' A' ' 48' ' ' ILE . 14.4 t 59.54 51.17 0.3 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 N-CA-C 107.56 -1.274 . . . . 0.0 107.56 -174.287 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' THR . . . . . 0.733 ' O ' ' HB2' ' A' ' 49' ' ' ALA . 41.3 p -33.12 -34.21 0.02 OUTLIER 'General case' 0 N--CA 1.498 1.954 0 CA-C-N 115.758 -0.655 . . . . 0.0 112.678 -176.485 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.417 ' N ' ' O ' ' A' ' 44' ' ' VAL . . . -73.34 -66.48 0.68 Allowed 'General case' 0 N--CA 1.491 1.585 0 O-C-N 120.98 -1.075 . . . . 0.0 110.369 179.622 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' ALA . . . . . 0.614 ' HB3' ' CG1' ' A' ' 44' ' ' VAL . . . -57.91 -42.15 84.14 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.432 -0.793 . . . . 0.0 110.62 -179.652 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ILE . . . . . 0.913 HG22 ' O ' ' A' ' 44' ' ' VAL . 2.3 tt -70.26 -24.82 26.3 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.544 0 O-C-N 121.078 -1.014 . . . . 0.0 110.656 -179.519 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ALA . . . . . 0.733 ' HB2' ' O ' ' A' ' 45' ' ' THR . . . -67.49 -57.37 6.65 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 120.995 -1.066 . . . . 0.0 109.616 -179.666 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 7.4 t -58.29 -38.84 77.81 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.431 -0.793 . . . . 0.0 109.753 178.877 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.719 ' O ' ' HB3' ' A' ' 55' ' ' ALA . 2.8 m-20 -73.67 -26.89 60.96 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.322 -0.861 . . . . 0.0 110.133 179.339 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ILE . . . . . 0.639 HD13 HG12 ' A' ' 83' ' ' ILE . 0.6 OUTLIER -60.63 -57.34 12.42 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.508 0 O-C-N 120.963 -1.086 . . . . 0.0 109.074 179.663 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' TRP . . . . . 0.528 ' CZ2' ' NH2' ' A' ' 85' ' ' ARG . 74.0 t-105 -63.88 -48.87 74.96 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.381 -0.825 . . . . 0.0 111.154 -178.878 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' ALA . . . . . 0.424 ' O ' ' HB2' ' A' ' 57' ' ' ASP . . . -74.38 -63.71 1.18 Allowed 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.314 -0.867 . . . . 0.0 111.767 -177.056 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' ALA . . . . . 0.719 ' HB3' ' O ' ' A' ' 51' ' ' ASN . . . -48.7 -46.31 40.42 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 120.959 -1.088 . . . . 0.0 110.784 -178.42 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.94 ' CD2' HG23 ' A' ' 72' ' ' ILE . 87.4 t80 -69.73 -26.68 64.44 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 118.678 -1.209 . . . . 0.0 109.327 178.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ASP . . . . . 0.424 ' HB2' ' O ' ' A' ' 54' ' ' ALA . 1.0 OUTLIER -53.87 -51.61 63.11 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.172 -0.955 . . . . 0.0 110.017 178.244 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -82.85 -57.26 3.38 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.414 -0.804 . . . . 0.0 110.729 -179.266 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASN . . . . . . . . . . . . . 4.0 t-20 -61.0 -39.74 90.83 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.25 -0.906 . . . . 0.0 110.701 -179.292 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLY . . . . . . . . . . . . . . . -94.1 -86.08 1.64 Allowed Glycine 0 N--CA 1.491 2.343 0 N-CA-C 109.597 -1.401 . . . . 0.0 109.597 -179.537 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -169.01 150.46 4.52 Favored 'General case' 0 N--CA 1.487 1.383 0 O-C-N 121.251 -1.146 . . . . 0.0 109.88 -179.908 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLN . . . . . . . . . . . . . 6.0 tt0 -109.54 149.69 29.26 Favored 'General case' 0 C--N 1.299 -1.604 0 O-C-N 121.347 -0.846 . . . . 0.0 110.721 -179.428 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . 0.463 ' HB3' ' HE2' ' A' ' 70' ' ' LYS . . . -117.57 -170.87 1.94 Allowed 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.399 -0.813 . . . . 0.0 110.036 179.32 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' PHE . . . . . 0.427 ' CD1' ' C ' ' A' ' 63' ' ' ALA . 80.3 m-85 -147.53 -82.08 0.13 Allowed 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.115 -0.991 . . . . 0.0 110.536 -179.956 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASN . . . . . . . . . . . . . 35.8 t-20 -120.06 110.7 16.97 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.111 -0.993 . . . . 0.0 110.67 -179.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -161.57 -45.94 0.04 OUTLIER 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.266 -0.896 . . . . 0.0 110.29 179.689 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ASP . . . . . . . . . . . . . 0.2 OUTLIER 52.39 23.14 2.33 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.241 -0.912 . . . . 0.0 110.574 179.547 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.57 ' HA ' HG23 ' A' ' 86' ' ' VAL . 18.0 m -161.41 24.48 0.13 Allowed 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.182 -0.948 . . . . 0.0 110.507 179.892 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' LEU . . . . . 0.431 ' O ' ' CD2' ' A' ' 69' ' ' LEU . 0.4 OUTLIER -169.65 24.44 0.02 OUTLIER 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.161 -0.962 . . . . 0.0 111.4 -179.346 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' LYS . . . . . 0.631 ' O ' HD12 ' A' ' 72' ' ' ILE . 4.0 mttt -88.86 68.54 8.48 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 120.935 -1.103 . . . . 0.0 109.814 179.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' PHE . . . . . 0.495 ' CZ ' ' HB3' ' A' ' 104' ' ' LEU . 18.8 t80 -83.76 120.78 26.44 Favored 'General case' 0 N--CA 1.487 1.423 0 O-C-N 121.093 -1.005 . . . . 0.0 110.765 -178.293 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' ILE . . . . . 0.94 HG23 ' CD2' ' A' ' 56' ' ' TYR . 2.2 mp -123.26 142.96 37.95 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.461 0 O-C-N 121.705 -0.622 . . . . 0.0 109.742 -179.902 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' LEU . . . . . 0.792 HD12 ' O ' ' A' ' 72' ' ' ILE . 1.6 mp -136.0 143.7 44.92 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.879 -1.138 . . . . 0.0 111.174 -177.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' MET . . . . . 0.536 ' O ' HG12 ' A' ' 81' ' ' VAL . 0.0 OUTLIER -160.43 166.06 29.93 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.365 -0.834 . . . . 0.0 110.237 178.969 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ASP . . . . . . . . . . . . . 3.1 p30 -127.54 165.84 19.12 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.132 -0.98 . . . . 0.0 110.557 -179.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -138.23 -61.97 0.59 Allowed 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.282 -0.886 . . . . 0.0 110.1 179.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -159.84 130.22 5.6 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.345 -0.847 . . . . 0.0 109.985 179.501 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLU . . . . . . . . . . . . . 39.1 mt-10 52.6 92.48 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.248 -0.908 . . . . 0.0 110.131 -179.437 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLY . . . . . . . . . . . . . . . 88.98 -166.05 33.52 Favored Glycine 0 N--CA 1.491 2.306 0 N-CA-C 109.103 -1.599 . . . . 0.0 109.103 -179.305 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ARG . . . . . . . . . . . . . 69.3 mtm180 -149.68 174.25 12.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.035 -1.274 . . . . 0.0 110.442 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' VAL . . . . . 0.536 HG12 ' O ' ' A' ' 74' ' ' MET . 13.4 p -113.7 144.69 20.79 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 O-C-N 121.257 -0.902 . . . . 0.0 110.676 179.997 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' ALA . . . . . 0.942 ' HB2' HG22 ' A' ' 99' ' ' VAL . . . -106.45 110.85 23.18 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 121.358 -0.839 . . . . 0.0 109.753 178.785 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' ILE . . . . . 0.764 HD13 HG22 ' A' ' 72' ' ' ILE . 1.4 mt -99.41 145.19 10.9 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 O-C-N 121.466 -0.771 . . . . 0.0 109.627 -179.911 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' THR . . . . . 0.662 HG22 ' O ' ' A' ' 91' ' ' LEU . 1.8 t -158.34 121.94 3.96 Favored 'General case' 0 N--CA 1.497 1.875 0 O-C-N 120.697 -1.252 . . . . 0.0 111.213 178.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' ARG . . . . . 0.528 ' NH2' ' CZ2' ' A' ' 53' ' ' TRP . 0.2 OUTLIER -97.8 120.98 39.15 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.331 -0.856 . . . . 0.0 109.976 179.114 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . 0.68 HG21 ' HA ' ' A' ' 109' ' ' GLN . 5.5 p -148.91 143.58 18.54 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.65 0 O-C-N 121.414 -0.804 . . . . 0.0 110.397 -179.591 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' ALA . . . . . 0.683 ' HB1' HD12 ' A' ' 119' ' ' LEU . . . 55.42 39.62 31.18 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.142 -0.974 . . . . 0.0 110.59 179.57 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' ASN . . . . . . . . . . . . . 54.1 t30 61.17 11.89 3.77 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.07 -1.019 . . . . 0.0 110.715 -179.114 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' LEU . . . . . 0.424 ' CD1' ' HA ' ' A' ' 26' ' ' ASN . 39.2 tp -132.1 133.86 44.8 Favored 'General case' 0 N--CA 1.488 1.465 0 O-C-N 121.119 -0.988 . . . . 0.0 108.84 178.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' LEU . . . . . 0.617 HD22 HD12 ' A' ' 25' ' ' LEU . 1.0 OUTLIER -106.61 136.69 45.97 Favored 'General case' 0 C--N 1.304 -1.413 0 O-C-N 120.966 -1.083 . . . . 0.0 111.634 -178.387 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' LEU . . . . . 0.662 ' O ' HG22 ' A' ' 84' ' ' THR . 4.1 tt -111.06 121.23 44.81 Favored 'General case' 0 C--N 1.302 -1.485 0 N-CA-C 108.939 -0.763 . . . . 0.0 108.939 176.22 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' CYS . . . . . 0.596 ' HB3' HD23 ' A' ' 23' ' ' LEU . 44.8 t -121.34 149.79 42.42 Favored 'General case' 0 C--N 1.297 -1.705 0 N-CA-C 108.85 -0.796 . . . . 0.0 108.85 179.887 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' MET . . . . . 0.427 ' O ' ' HA ' ' A' ' 81' ' ' VAL . 11.9 ptp -158.67 145.14 17.13 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 120.732 -1.23 . . . . 0.0 111.938 -178.178 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' TYR . . . . . 0.429 ' HB2' ' HD2' ' A' ' 43' ' ' ARG . 1.1 t80 -91.74 118.41 30.65 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 108.035 -1.098 . . . . 0.0 108.035 174.932 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' ALA . . . . . 1.07 ' HB3' HG23 ' A' ' 99' ' ' VAL . . . -150.14 173.21 14.16 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.353 -0.842 . . . . 0.0 110.212 -177.673 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 26.3 tttp -112.84 -34.19 5.85 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.303 -0.873 . . . . 0.0 109.937 179.263 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' GLU . . . . . . . . . . . . . 1.8 tm-20 -119.16 -38.37 3.05 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.443 -0.786 . . . . 0.0 110.114 179.323 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' THR . . . . . 0.506 ' HB ' ' HB1' ' A' ' 95' ' ' ALA . 27.9 m -53.33 -27.07 21.44 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.288 -0.882 . . . . 0.0 110.11 179.254 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' VAL . . . . . 1.07 HG23 ' HB3' ' A' ' 95' ' ' ALA . 78.9 t -77.05 70.73 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.301 -0.875 . . . . 0.0 110.032 179.549 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' GLY . . . . . . . . . . . . . . . -63.38 -145.97 0.02 OUTLIER Glycine 0 N--CA 1.489 2.167 0 N-CA-C 109.523 -1.431 . . . . 0.0 109.523 -179.862 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -144.69 -75.0 0.24 Allowed 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.182 -1.187 . . . . 0.0 110.484 179.868 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' GLY . . . . . . . . . . . . . . . -89.12 -59.11 1.6 Allowed Glycine 0 N--CA 1.49 2.262 0 N-CA-C 109.276 -1.53 . . . . 0.0 109.276 179.732 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' MET . . . . . 0.416 ' HE2' ' HB3' ' A' ' 103' ' ' MET . 0.1 OUTLIER -52.22 -34.13 44.32 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 121.281 -1.129 . . . . 0.0 110.241 179.382 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.495 ' HB3' ' CZ ' ' A' ' 71' ' ' PHE . 0.2 OUTLIER -62.69 -33.24 74.67 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.251 -0.905 . . . . 0.0 110.548 -179.698 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' LYS . . . . . 0.477 ' HG2' ' CG ' ' A' ' 71' ' ' PHE . 2.8 mtmm -54.63 -65.83 0.51 Allowed 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.242 -0.911 . . . . 0.0 110.122 179.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 106' ' ' ALA . . . . . . . . . . . . . . . -58.24 -30.69 66.73 Favored 'General case' 0 N--CA 1.488 1.469 0 O-C-N 121.287 -0.883 . . . . 0.0 109.894 179.221 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 107' ' ' LYS . . . . . 0.416 ' HD3' ' HE3' ' A' ' 103' ' ' MET . 4.5 tttp -62.53 -36.76 83.64 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.323 -0.861 . . . . 0.0 109.982 179.277 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 108' ' ' ALA . . . . . . . . . . . . . . . -69.38 -55.49 10.23 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.345 -0.847 . . . . 0.0 110.073 179.473 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 109' ' ' GLN . . . . . 0.68 ' HA ' HG21 ' A' ' 86' ' ' VAL . 0.0 OUTLIER -50.45 -44.93 55.71 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.139 -0.976 . . . . 0.0 109.749 178.781 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 110' ' ' ALA . . . . . . . . . . . . . . . -65.07 -40.67 95.02 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.389 -0.819 . . . . 0.0 109.164 177.384 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 111' ' ' LEU . . . . . 0.634 HD23 HD22 ' A' ' 115' ' ' LEU . 0.8 OUTLIER -48.17 -30.34 4.53 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.372 -0.83 . . . . 0.0 110.243 178.75 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 112' ' ' VAL . . . . . 0.422 ' O ' ' CD ' ' A' ' 118' ' ' PRO . 75.9 t -83.03 -46.64 18.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 121.525 -0.734 . . . . 0.0 110.611 179.713 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 113' ' ' GLN . . . . . . . . . . . . . 6.5 tm0? -85.58 -37.44 19.57 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.194 -0.941 . . . . 0.0 112.016 -176.912 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 114' ' ' TYR . . . . . . . . . . . . . 14.3 m-85 -72.24 -63.61 1.11 Allowed 'General case' 0 N--CA 1.492 1.67 0 O-C-N 120.882 -1.136 . . . . 0.0 111.309 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 115' ' ' LEU . . . . . 0.689 HD23 ' HB2' ' A' ' 7' ' ' LEU . 8.3 mp -48.27 -77.93 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.784 0 O-C-N 121.027 -1.046 . . . . 0.0 110.785 -179.114 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 116' ' ' GLU . . . . . 0.458 ' C ' ' HD3' ' A' ' 118' ' ' PRO . 3.1 tt0 -97.21 -156.33 0.53 Allowed 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.175 -0.953 . . . . 0.0 109.915 178.764 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 117' ' ' GLU . . . . . 0.504 ' N ' ' HD3' ' A' ' 118' ' ' PRO . 24.9 tt0 -138.74 62.53 28.56 Favored Pre-proline 0 C--N 1.298 -1.641 0 N-CA-C 107.6 -1.259 . . . . 0.0 107.6 173.429 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 118' ' ' PRO . . . . . 0.504 ' HD3' ' N ' ' A' ' 117' ' ' GLU . 53.7 Cg_endo -112.09 -172.58 0.03 OUTLIER 'Trans proline' 0 C--N 1.317 -1.131 0 C-N-CA 121.528 1.486 . . . . 0.0 110.73 -173.057 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 119' ' ' LEU . . . . . 0.924 ' O ' ' HB3' ' A' ' 123' ' ' ALA . 4.4 mm? 61.76 -60.0 0.11 Allowed 'General case' 0 N--CA 1.5 2.064 0 N-CA-C 112.563 0.579 . . . . 0.0 112.563 177.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 120' ' ' THR . . . . . 0.479 ' N ' ' O ' ' A' ' 118' ' ' PRO . 80.6 p -44.79 -28.93 0.7 Allowed 'General case' 0 N--CA 1.496 1.829 0 O-C-N 121.153 -0.967 . . . . 0.0 111.363 -178.222 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 121' ' ' GLN . . . . . 0.539 ' C ' HG12 ' A' ' 122' ' ' VAL . 32.1 mt-30 -65.07 124.83 23.11 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.095 -1.003 . . . . 0.0 109.529 178.338 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 122' ' ' VAL . . . . . 0.568 HG22 ' O ' ' A' ' 122' ' ' VAL . 14.7 p 38.27 48.17 0.28 Allowed 'Isoleucine or valine' 0 N--CA 1.504 2.273 0 CA-C-O 121.4 0.619 . . . . 0.0 111.524 -178.811 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 123' ' ' ALA . . . . . 0.924 ' HB3' ' O ' ' A' ' 119' ' ' LEU . . . -168.61 -37.05 0.02 OUTLIER 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.312 -0.867 . . . . 0.0 110.527 -179.653 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 124' ' ' ALA . . . . . 0.463 ' HB3' ' O ' ' A' ' 123' ' ' ALA . . . 57.76 95.93 0.02 OUTLIER 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.257 -0.902 . . . . 0.0 110.398 -179.593 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 125' ' ' SER . . . . . 0.518 ' HB2' ' HB2' ' A' ' 87' ' ' ALA . 71.1 p . . . . . 0 N--CA 1.491 1.58 0 CA-C-O 118.018 -0.991 . . . . 0.0 110.347 179.968 . . . . . . . . 1 1 . 1 stop_ save_