data_1chc_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 1chc _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 full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 120.988 0.423 . . . . 0.0 110.487 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -119.32 96.29 5.15 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.506 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 48.4 p -106.85 63.63 0.64 Allowed 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.543 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.7 p -120.42 168.86 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 CA-C-N 113.995 -1.457 . . . . 0.0 109.832 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -44.83 161.3 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -125.04 44.94 2.67 Favored 'General case' 0 N--CA 1.5 2.027 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.086 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -2.18 67.74 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 117.991 2.589 . . . . 0.0 117.991 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' CYS . . . . . 0.488 ' C ' ' H ' ' A' ' 10' ' ' ILE . 1.0 OUTLIER -10.25 101.09 0.04 OUTLIER Pre-proline 0 N--CA 1.509 2.496 0 N-CA-C 118.694 2.85 . . . . 0.0 118.694 179.692 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -49.1 -2.7 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.648 0 C-N-CA 123.9 3.066 . . . . 0.0 115.099 165.175 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.488 ' H ' ' C ' ' A' ' 8' ' ' CYS . 10.3 tt -113.39 -51.88 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 123.786 0.679 . . . . 0.0 112.814 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' CYS . . . . . 0.467 ' SG ' ' N ' ' A' ' 12' ' ' LEU . 1.7 p -111.19 -57.14 2.28 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 123.676 0.61 . . . . 0.0 110.37 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LEU . . . . . 0.467 ' N ' ' SG ' ' A' ' 11' ' ' CYS . 3.2 tt 64.85 60.55 0.83 Allowed 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 123.122 1.439 . . . . 0.0 110.667 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -126.35 43.34 3.11 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 101.447 -3.538 . . . . 0.0 101.447 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 67.85 104.81 0.03 OUTLIER Pre-proline 0 N--CA 1.495 1.821 0 N-CA-C 104.78 -2.304 . . . . 0.0 104.78 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' PRO . . . . . 0.614 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 1.5 Cg_endo -84.28 46.35 1.94 Allowed 'Trans proline' 0 CA--C 1.564 1.983 0 C-N-CA 122.729 2.286 . . . . 0.0 110.331 -165.119 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.7 t -22.43 -69.17 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 117.713 2.486 . . . . 0.0 117.713 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -84.56 174.13 10.25 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' TYR . . . . . 0.545 ' CD1' ' HB2' ' A' ' 27' ' ' ALA . 32.5 m-85 -138.36 140.88 39.62 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 119.061 2.985 . . . . 0.0 119.061 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . 0.516 ' CB ' ' H ' ' A' ' 31' ' ' VAL . 19.7 p -129.66 109.76 11.24 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 100.352 -3.944 . . . . 0.0 100.352 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' MET . . . . . . . . . . . . . 36.2 mtm -96.52 126.02 41.41 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 -179.94 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -87.72 121.44 30.14 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 102.14 -3.282 . . . . 0.0 102.14 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.404 ' HA ' ' H ' ' A' ' 24' ' ' CYS . 4.5 mm? -102.02 162.28 20.84 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 126.371 2.295 . . . . 0.0 110.558 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -80.02 37.39 0.81 Allowed 'Cis proline' 0 N--CA 1.495 1.612 0 O-C-N 122.784 0.886 . . . . 0.0 114.175 -8.22 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' CYS . . . . . 0.407 ' SG ' HG23 ' A' ' 48' ' ' VAL . 13.3 p -121.83 21.84 10.6 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 1.1 pt? 3.25 59.87 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 117.988 2.588 . . . . 0.0 117.988 -179.534 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' HIS . . . . . 0.483 ' CD2' HD21 ' A' ' 45' ' ' LEU . 6.3 m80 -93.99 127.58 39.85 Favored 'General case' 0 N--CA 1.501 2.089 1 N-CA-C 97.725 -4.917 . . . . 0.0 97.725 179.303 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' ALA . . . . . 0.545 ' HB2' ' CD1' ' A' ' 18' ' ' TYR . . . -96.12 109.51 21.93 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' PHE . . . . . 0.587 ' CG ' ' HB ' ' A' ' 33' ' ' ILE . 86.8 m-85 -97.37 170.39 9.1 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 110.775 -2.921 . . . . 0.0 104.483 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' CYS . . . . . 0.614 ' SG ' ' HA ' ' A' ' 15' ' ' PRO . 93.3 m -59.87 169.34 1.47 Allowed 'General case' 0 N--CA 1.53 3.534 0 CA-C-N 122.496 2.407 . . . . 0.0 106.764 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' TYR . . . . . 0.469 ' HA ' ' HB3' ' A' ' 19' ' ' SER . 1.8 t80 -47.34 131.26 13.44 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 106.036 -1.839 . . . . 0.0 106.036 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.516 ' H ' ' CB ' ' A' ' 19' ' ' SER 0.294 12.4 p 25.36 37.93 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.763 0 N-CA-C 117.596 2.443 . . . . 0.0 117.596 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . 0.601 ' SG ' ' HB2' ' A' ' 29' ' ' CYS . 1.2 m -72.77 -64.71 0.91 Allowed 'General case' 0 N--CA 1.517 2.896 0 N-CA-C 101.994 -3.336 . . . . 0.0 101.994 179.198 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ILE . . . . . 0.587 ' HB ' ' CG ' ' A' ' 28' ' ' PHE . 2.3 tp -39.84 -42.67 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-N 112.498 -2.137 . . . . 0.0 113.296 179.291 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.9 m -45.82 -54.67 7.69 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.2 mmm-85 -50.37 -53.07 31.84 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-N 114.044 -1.435 . . . . 0.0 107.755 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.501 ' CE2' ' HB3' ' A' ' 44' ' ' PRO . 5.5 t-105 -52.06 -65.15 0.61 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.361 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 36.9 pt -50.91 -47.62 29.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 66.8 mtt-85 -45.68 -29.65 1.32 Allowed 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 51.6 tp60 -102.86 -45.84 4.86 Favored 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -123.27 78.32 52.97 Favored Pre-proline 0 N--CA 1.491 1.578 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.033 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -53.08 -161.22 0.0 OUTLIER 'Trans proline' 0 N--CA 1.502 1.993 0 C-N-CA 124.387 3.391 . . . . 0.0 112.675 176.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.418 ' C ' ' HA ' ' A' ' 47' ' ' LYS . 67.3 p 47.55 79.26 0.07 Allowed 'General case' 0 N--CA 1.507 2.382 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 42.0 t -9.79 129.28 0.01 OUTLIER Pre-proline 0 N--CA 1.497 1.888 0 CA-C-N 111.005 -2.816 . . . . 0.0 116.501 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' PRO . . . . . 0.501 ' HB3' ' CE2' ' A' ' 36' ' ' TRP . 58.9 Cg_endo -58.67 -20.97 53.37 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 123.537 2.825 . . . . 0.0 110.431 -176.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.483 HD21 ' CD2' ' A' ' 26' ' ' HIS . 9.7 tp -102.67 -42.66 5.83 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 113.84 -1.527 . . . . 0.0 114.078 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 15.1 p -137.91 43.9 2.21 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LYS . . . . . 0.418 ' HA ' ' C ' ' A' ' 42' ' ' THR . 49.4 mmtm 19.78 57.22 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.407 HG23 ' SG ' ' A' ' 24' ' ' CYS . 3.6 m -111.06 142.89 27.21 Favored Pre-proline 0 N--CA 1.504 2.264 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 179.48 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -79.21 69.92 7.72 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.917 2.411 . . . . 0.0 107.705 -178.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 62.0 t -24.63 146.04 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 N-CA-C 115.747 1.758 . . . . 0.0 115.747 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -112.37 -65.18 1.2 Allowed 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 113.12 -1.855 . . . . 0.0 111.501 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.7 m -133.98 169.25 17.4 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.3 m -130.2 131.86 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.5 p -116.01 139.18 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' HIS . . . . . . . . . . . . . 1.5 p80 -118.53 87.74 2.79 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 125.205 1.566 . . . . 0.0 110.282 -179.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 61.9 m -94.64 72.77 3.67 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ILE . . . . . . . . . . . . . 39.1 mt -105.78 170.45 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-N 111.86 -2.427 . . . . 0.0 106.309 -179.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -114.3 -176.19 2.85 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.9 m 4.22 75.75 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 117.187 2.291 . . . . 0.0 117.187 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.407 ' O ' ' CB ' ' A' ' 61' ' ' SER . 1.7 p30 -115.35 167.72 10.61 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.017 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' SER . . . . . 0.407 ' CB ' ' O ' ' A' ' 60' ' ' ASP . 50.4 p 137.09 83.1 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.713 0 O-C-N 125.623 1.827 . . . . 0.0 107.888 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -105.73 179.65 4.21 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.359 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 64.39 179.12 0.17 Allowed 'General case' 0 N--CA 1.504 2.232 0 O-C-N 124.63 1.206 . . . . 0.0 112.806 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.21 -59.4 0.28 Allowed Glycine 0 N--CA 1.495 2.627 0 N-CA-C 108.197 -1.961 . . . . 0.0 108.197 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -118.36 -142.84 0.36 Allowed 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.1 pm0 -106.14 -35.29 7.26 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 123.068 0.23 . . . . 0.0 111.1 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 79.8 mt -115.3 -44.36 3.0 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 123.838 0.711 . . . . 0.0 111.239 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' ILE . . . . . 0.514 ' H ' HD11 ' A' ' 68' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.145 0 CA-C-O 117.314 -1.327 . . . . 0.0 112.039 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 120.988 0.423 . . . . 0.0 110.487 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -119.32 96.29 5.15 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.506 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 48.4 p -106.85 63.63 0.64 Allowed 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.543 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.7 p -120.42 168.86 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 CA-C-N 113.995 -1.457 . . . . 0.0 109.832 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -44.83 161.3 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -125.04 44.94 2.67 Favored 'General case' 0 N--CA 1.5 2.027 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.086 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -2.18 67.74 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 117.991 2.589 . . . . 0.0 117.991 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' CYS . . . . . 0.513 ' HB3' ' H ' ' A' ' 11' ' ' CYS . 1.0 OUTLIER -10.25 101.09 0.04 OUTLIER Pre-proline 0 N--CA 1.509 2.496 0 N-CA-C 118.694 2.85 . . . . 0.0 118.694 179.692 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -49.1 -2.7 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.648 0 C-N-CA 123.9 3.066 . . . . 0.0 115.099 165.175 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.564 HG21 ' HB3' ' A' ' 32' ' ' CYS . 10.3 tt -113.39 -51.88 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 123.786 0.679 . . . . 0.0 112.814 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' CYS . . . . . 0.513 ' H ' ' HB3' ' A' ' 8' ' ' CYS . 1.7 p -111.19 -57.14 2.28 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 123.676 0.61 . . . . 0.0 110.37 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LEU . . . . . 0.467 ' N ' ' SG ' ' A' ' 11' ' ' CYS . 3.2 tt 64.85 60.55 0.83 Allowed 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 123.122 1.439 . . . . 0.0 110.667 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -126.35 43.34 3.11 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 101.447 -3.538 . . . . 0.0 101.447 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 67.85 104.81 0.03 OUTLIER Pre-proline 0 N--CA 1.495 1.821 0 N-CA-C 104.78 -2.304 . . . . 0.0 104.78 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' PRO . . . . . 0.679 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 1.5 Cg_endo -84.28 46.35 1.94 Allowed 'Trans proline' 0 CA--C 1.564 1.983 0 C-N-CA 122.729 2.286 . . . . 0.0 110.331 -165.119 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.7 t -22.43 -69.17 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 117.713 2.486 . . . . 0.0 117.713 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -84.56 174.13 10.25 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' TYR . . . . . 0.671 ' CD1' ' HB1' ' A' ' 27' ' ' ALA . 32.5 m-85 -138.36 140.88 39.62 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 119.061 2.985 . . . . 0.0 119.061 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . 0.666 ' HB3' ' H ' ' A' ' 31' ' ' VAL . 19.7 p -129.66 109.76 11.24 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 100.352 -3.944 . . . . 0.0 100.352 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' MET . . . . . 0.483 ' HG2' ' HB2' ' A' ' 27' ' ' ALA . 36.2 mtm -96.52 126.02 41.41 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -87.72 121.44 30.14 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 102.14 -3.282 . . . . 0.0 102.14 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.404 ' HA ' ' H ' ' A' ' 24' ' ' CYS . 4.5 mm? -102.02 162.28 20.84 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 126.371 2.295 . . . . 0.0 110.558 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -80.02 37.39 0.81 Allowed 'Cis proline' 0 N--CA 1.495 1.612 0 O-C-N 122.784 0.886 . . . . 0.0 114.175 -8.22 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' CYS . . . . . 0.421 ' SG ' HG21 ' A' ' 48' ' ' VAL . 13.3 p -121.83 21.84 10.6 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.422 HD23 ' N ' ' A' ' 25' ' ' LEU . 1.1 pt? 3.25 59.87 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 117.988 2.588 . . . . 0.0 117.988 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' HIS . . . . . 0.544 ' CD2' HD23 ' A' ' 45' ' ' LEU . 6.3 m80 -93.99 127.58 39.85 Favored 'General case' 0 N--CA 1.501 2.089 1 N-CA-C 97.725 -4.917 . . . . 0.0 97.725 179.303 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 27' ' ' ALA . . . . . 0.671 ' HB1' ' CD1' ' A' ' 18' ' ' TYR . . . -96.12 109.51 21.93 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' PHE . . . . . 0.576 ' CG ' ' HB ' ' A' ' 33' ' ' ILE . 86.8 m-85 -97.37 170.39 9.1 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 110.775 -2.921 . . . . 0.0 104.483 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' CYS . . . . . 0.679 ' SG ' ' HA ' ' A' ' 15' ' ' PRO . 93.3 m -59.87 169.34 1.47 Allowed 'General case' 0 N--CA 1.53 3.534 0 CA-C-N 122.496 2.407 . . . . 0.0 106.764 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' TYR . . . . . 0.432 ' HA ' ' HB3' ' A' ' 19' ' ' SER . 1.8 t80 -47.34 131.26 13.44 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 106.036 -1.839 . . . . 0.0 106.036 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.666 ' H ' ' HB3' ' A' ' 19' ' ' SER 0.294 12.4 p 25.36 37.93 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.763 0 N-CA-C 117.596 2.443 . . . . 0.0 117.596 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' HB2' ' A' ' 29' ' ' CYS . 1.2 m -72.77 -64.71 0.91 Allowed 'General case' 0 N--CA 1.517 2.896 0 N-CA-C 101.994 -3.336 . . . . 0.0 101.994 179.198 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ILE . . . . . 0.576 ' HB ' ' CG ' ' A' ' 28' ' ' PHE . 2.3 tp -39.84 -42.67 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-N 112.498 -2.137 . . . . 0.0 113.296 179.291 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.9 m -45.82 -54.67 7.69 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.2 mmm-85 -50.37 -53.07 31.84 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-N 114.044 -1.435 . . . . 0.0 107.755 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.515 ' CE2' ' HB3' ' A' ' 44' ' ' PRO . 5.5 t-105 -52.06 -65.15 0.61 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.361 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 36.9 pt -50.91 -47.62 29.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 66.8 mtt-85 -45.68 -29.65 1.32 Allowed 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 51.6 tp60 -102.86 -45.84 4.86 Favored 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -123.27 78.32 52.97 Favored Pre-proline 0 N--CA 1.491 1.578 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.033 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -53.08 -161.22 0.0 OUTLIER 'Trans proline' 0 N--CA 1.502 1.993 0 C-N-CA 124.387 3.391 . . . . 0.0 112.675 176.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.479 ' C ' ' HA ' ' A' ' 47' ' ' LYS . 67.3 p 47.55 79.26 0.07 Allowed 'General case' 0 N--CA 1.507 2.382 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 42.0 t -9.79 129.28 0.01 OUTLIER Pre-proline 0 N--CA 1.497 1.888 0 CA-C-N 111.005 -2.816 . . . . 0.0 116.501 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' PRO . . . . . 0.515 ' HB3' ' CE2' ' A' ' 36' ' ' TRP . 58.9 Cg_endo -58.67 -20.97 53.37 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 123.537 2.825 . . . . 0.0 110.431 -176.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.544 HD23 ' CD2' ' A' ' 26' ' ' HIS . 9.7 tp -102.67 -42.66 5.83 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 113.84 -1.527 . . . . 0.0 114.078 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 15.1 p -137.91 43.9 2.21 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HA ' ' C ' ' A' ' 42' ' ' THR . 49.4 mmtm 19.78 57.22 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.421 HG21 ' SG ' ' A' ' 24' ' ' CYS . 3.6 m -111.06 142.89 27.21 Favored Pre-proline 0 N--CA 1.504 2.264 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 179.48 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -79.21 69.92 7.72 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.917 2.411 . . . . 0.0 107.705 -178.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 62.0 t -24.63 146.04 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 N-CA-C 115.747 1.758 . . . . 0.0 115.747 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -112.37 -65.18 1.2 Allowed 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 113.12 -1.855 . . . . 0.0 111.501 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.7 m -133.98 169.25 17.4 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.3 m -130.2 131.86 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.5 p -116.01 139.18 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' HIS . . . . . 0.43 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 1.4 p-80 -118.53 87.74 2.79 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 125.205 1.566 . . . . 0.0 110.282 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 61.9 m -94.64 72.77 3.67 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ILE . . . . . 0.462 HG12 ' H ' ' A' ' 18' ' ' TYR . 39.1 mt -105.78 170.45 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-N 111.86 -2.427 . . . . 0.0 106.309 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -114.3 -176.19 2.85 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.9 m 4.22 75.75 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 117.187 2.291 . . . . 0.0 117.187 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.407 ' O ' ' CB ' ' A' ' 61' ' ' SER . 1.7 p30 -115.35 167.72 10.61 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.017 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' SER . . . . . 0.407 ' CB ' ' O ' ' A' ' 60' ' ' ASP . 50.4 p 137.09 83.1 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.713 0 O-C-N 125.623 1.827 . . . . 0.0 107.888 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -105.73 179.65 4.21 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.359 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 64.39 179.12 0.17 Allowed 'General case' 0 N--CA 1.504 2.232 0 O-C-N 124.63 1.206 . . . . 0.0 112.806 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.21 -59.4 0.28 Allowed Glycine 0 N--CA 1.495 2.627 0 N-CA-C 108.197 -1.961 . . . . 0.0 108.197 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -118.36 -142.84 0.36 Allowed 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.1 pm0 -106.14 -35.29 7.26 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 123.068 0.23 . . . . 0.0 111.1 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 79.8 mt -115.3 -44.36 3.0 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 123.838 0.711 . . . . 0.0 111.239 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' ILE . . . . . 0.688 HD13 ' H ' ' A' ' 68' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.145 0 CA-C-O 117.314 -1.327 . . . . 0.0 112.039 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 71' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 3.7 mpp? . . . . . 0 N--CA 1.493 1.724 0 CA-C-O 120.988 0.423 . . . . 0.0 110.487 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' ALA . . . . . . . . . . . . . . . -119.32 96.29 5.15 Favored 'General case' 0 N--CA 1.498 1.951 0 CA-C-N 115.015 -0.993 . . . . 0.0 109.506 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' THR . . . . . . . . . . . . . 48.4 p -106.85 63.63 0.64 Allowed 'General case' 0 N--CA 1.498 1.953 0 CA-C-N 114.836 -1.075 . . . . 0.0 109.543 -179.887 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 12.7 p -120.42 168.86 12.36 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.062 0 CA-C-N 113.995 -1.457 . . . . 0.0 109.832 179.995 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ALA . . . . . . . . . . . . . . . -44.83 161.3 0.03 OUTLIER 'General case' 0 N--CA 1.505 2.287 0 N-CA-C 114.211 1.189 . . . . 0.0 114.211 179.902 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 52.2 mt-10 -125.04 44.94 2.67 Favored 'General case' 0 N--CA 1.5 2.027 0 CA-C-N 115.445 -0.798 . . . . 0.0 111.086 -179.983 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -2.18 67.74 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.972 0 N-CA-C 117.991 2.589 . . . . 0.0 117.991 179.897 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' CYS . . . . . 0.513 ' HB3' ' H ' ' A' ' 11' ' ' CYS . 1.0 OUTLIER -10.25 101.09 0.04 OUTLIER Pre-proline 0 N--CA 1.509 2.496 0 N-CA-C 118.694 2.85 . . . . 0.0 118.694 179.692 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' PRO . . . . . . . . . . . . . 85.2 Cg_exo -49.1 -2.7 0.04 OUTLIER 'Trans proline' 0 N--CA 1.496 1.648 0 C-N-CA 123.9 3.066 . . . . 0.0 115.099 165.175 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.564 HG21 ' HB3' ' A' ' 32' ' ' CYS . 10.3 tt -113.39 -51.88 5.34 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.696 0 O-C-N 123.786 0.679 . . . . 0.0 112.814 -179.861 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' CYS . . . . . 0.513 ' H ' ' HB3' ' A' ' 8' ' ' CYS . 1.7 p -111.19 -57.14 2.28 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 123.676 0.61 . . . . 0.0 110.37 -179.774 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LEU . . . . . 0.467 ' N ' ' SG ' ' A' ' 11' ' ' CYS . 3.2 tt 64.85 60.55 0.83 Allowed 'General case' 0 N--CA 1.496 1.831 0 CA-C-O 123.122 1.439 . . . . 0.0 110.667 179.894 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 52.4 tp10 -126.35 43.34 3.11 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 101.447 -3.538 . . . . 0.0 101.447 179.326 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 67.85 104.81 0.03 OUTLIER Pre-proline 0 N--CA 1.495 1.821 0 N-CA-C 104.78 -2.304 . . . . 0.0 104.78 -179.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' PRO . . . . . 0.679 ' HA ' ' SG ' ' A' ' 29' ' ' CYS . 1.5 Cg_endo -84.28 46.35 1.94 Allowed 'Trans proline' 0 CA--C 1.564 1.983 0 C-N-CA 122.729 2.286 . . . . 0.0 110.331 -165.119 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' SER . . . . . . . . . . . . . 35.7 t -22.43 -69.17 0.03 OUTLIER 'General case' 0 N--CA 1.504 2.255 0 N-CA-C 117.713 2.486 . . . . 0.0 117.713 179.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -84.56 174.13 10.25 Favored 'General case' 0 N--CA 1.498 1.952 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 -179.806 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' TYR . . . . . 0.671 ' CD1' ' HB1' ' A' ' 27' ' ' ALA . 32.5 m-85 -138.36 140.88 39.62 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 119.061 2.985 . . . . 0.0 119.061 -179.849 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . 0.666 ' HB3' ' H ' ' A' ' 31' ' ' VAL . 19.7 p -129.66 109.76 11.24 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 100.352 -3.944 . . . . 0.0 100.352 179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' MET . . . . . 0.483 ' HG2' ' HB2' ' A' ' 27' ' ' ALA . 36.2 mtm -96.52 126.02 41.41 Favored 'General case' 0 N--CA 1.491 1.595 0 N-CA-C 105.318 -2.104 . . . . 0.0 105.318 -179.94 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ALA . . . . . . . . . . . . . . . -87.72 121.44 30.14 Favored 'General case' 0 N--CA 1.49 1.569 0 N-CA-C 102.14 -3.282 . . . . 0.0 102.14 179.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.404 ' HA ' ' H ' ' A' ' 24' ' ' CYS . 4.5 mm? -102.02 162.28 20.84 Favored Pre-proline 0 N--CA 1.492 1.656 0 O-C-N 126.371 2.295 . . . . 0.0 110.558 -179.55 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' PRO . . . . . . . . . . . . . 12.9 Cg_endo -80.02 37.39 0.81 Allowed 'Cis proline' 0 N--CA 1.495 1.612 0 O-C-N 122.784 0.886 . . . . 0.0 114.175 -8.22 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' CYS . . . . . 0.421 ' SG ' HG21 ' A' ' 48' ' ' VAL . 13.3 p -121.83 21.84 10.6 Favored 'General case' 0 N--CA 1.5 2.06 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 179.825 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.422 HD23 ' N ' ' A' ' 25' ' ' LEU . 1.1 pt? 3.25 59.87 0.0 OUTLIER 'General case' 0 N--CA 1.501 2.09 0 N-CA-C 117.988 2.588 . . . . 0.0 117.988 -179.534 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' HIS . . . . . 0.544 ' CD2' HD23 ' A' ' 45' ' ' LEU . 6.3 m80 -93.99 127.58 39.85 Favored 'General case' 0 N--CA 1.501 2.089 1 N-CA-C 97.725 -4.917 . . . . 0.0 97.725 179.303 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' ALA . . . . . 0.671 ' HB1' ' CD1' ' A' ' 18' ' ' TYR . . . -96.12 109.51 21.93 Favored 'General case' 0 C--N 1.305 -1.329 0 N-CA-C 115.216 1.561 . . . . 0.0 115.216 -179.217 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' PHE . . . . . 0.576 ' CG ' ' HB ' ' A' ' 33' ' ' ILE . 86.8 m-85 -97.37 170.39 9.1 Favored 'General case' 0 N--CA 1.498 1.95 0 CA-C-N 110.775 -2.921 . . . . 0.0 104.483 179.424 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' CYS . . . . . 0.679 ' SG ' ' HA ' ' A' ' 15' ' ' PRO . 93.3 m -59.87 169.34 1.47 Allowed 'General case' 0 N--CA 1.53 3.534 0 CA-C-N 122.496 2.407 . . . . 0.0 106.764 179.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' TYR . . . . . 0.432 ' HA ' ' HB3' ' A' ' 19' ' ' SER . 1.8 t80 -47.34 131.26 13.44 Favored 'General case' 0 N--CA 1.499 1.991 0 N-CA-C 106.036 -1.839 . . . . 0.0 106.036 179.646 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.666 ' H ' ' HB3' ' A' ' 19' ' ' SER 0.294 12.4 p 25.36 37.93 0.05 OUTLIER 'Isoleucine or valine' 0 C--N 1.295 -1.763 0 N-CA-C 117.596 2.443 . . . . 0.0 117.596 -179.755 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.609 ' SG ' ' HB2' ' A' ' 29' ' ' CYS . 1.2 m -72.77 -64.71 0.91 Allowed 'General case' 0 N--CA 1.517 2.896 0 N-CA-C 101.994 -3.336 . . . . 0.0 101.994 179.198 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ILE . . . . . 0.576 ' HB ' ' CG ' ' A' ' 28' ' ' PHE . 2.3 tp -39.84 -42.67 0.51 Allowed 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 CA-C-N 112.498 -2.137 . . . . 0.0 113.296 179.291 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' THR . . . . . . . . . . . . . 96.9 m -45.82 -54.67 7.69 Favored 'General case' 0 N--CA 1.498 1.958 0 N-CA-C 108.166 -1.05 . . . . 0.0 108.166 179.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ARG . . . . . . . . . . . . . 15.2 mmm-85 -50.37 -53.07 31.84 Favored 'General case' 0 N--CA 1.493 1.712 0 CA-C-N 114.044 -1.435 . . . . 0.0 107.755 179.536 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.515 ' CE2' ' HB3' ' A' ' 44' ' ' PRO . 5.5 t-105 -52.06 -65.15 0.61 Allowed 'General case' 0 N--CA 1.499 2.013 0 CA-C-N 115.163 -0.926 . . . . 0.0 112.361 179.856 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ILE . . . . . . . . . . . . . 36.9 pt -50.91 -47.62 29.7 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.096 0 N-CA-C 115.195 1.554 . . . . 0.0 115.195 -179.324 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ARG . . . . . . . . . . . . . 66.8 mtt-85 -45.68 -29.65 1.32 Allowed 'General case' 0 N--CA 1.504 2.274 0 N-CA-C 114.374 1.25 . . . . 0.0 114.374 179.86 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 51.6 tp60 -102.86 -45.84 4.86 Favored 'General case' 0 N--CA 1.497 1.906 0 N-CA-C 108.018 -1.105 . . . . 0.0 108.018 179.971 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ASN . . . . . . . . . . . . . 72.8 m-80 -123.27 78.32 52.97 Favored Pre-proline 0 N--CA 1.491 1.578 0 CA-C-N 113.638 -1.619 . . . . 0.0 111.033 -179.987 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_exo -53.08 -161.22 0.0 OUTLIER 'Trans proline' 0 N--CA 1.502 1.993 0 C-N-CA 124.387 3.391 . . . . 0.0 112.675 176.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.479 ' C ' ' HA ' ' A' ' 47' ' ' LYS . 67.3 p 47.55 79.26 0.07 Allowed 'General case' 0 N--CA 1.507 2.382 0 N-CA-C 108.144 -1.058 . . . . 0.0 108.144 -179.893 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' CYS . . . . . . . . . . . . . 42.0 t -9.79 129.28 0.01 OUTLIER Pre-proline 0 N--CA 1.497 1.888 0 CA-C-N 111.005 -2.816 . . . . 0.0 116.501 -179.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' PRO . . . . . 0.515 ' HB3' ' CE2' ' A' ' 36' ' ' TRP . 58.9 Cg_endo -58.67 -20.97 53.37 Favored 'Trans proline' 0 N--CA 1.49 1.28 0 C-N-CA 123.537 2.825 . . . . 0.0 110.431 -176.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.544 HD23 ' CD2' ' A' ' 26' ' ' HIS . 9.7 tp -102.67 -42.66 5.83 Favored 'General case' 0 N--CA 1.487 1.391 0 CA-C-N 113.84 -1.527 . . . . 0.0 114.078 -179.623 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' CYS . . . . . . . . . . . . . 15.1 p -137.91 43.9 2.21 Favored 'General case' 0 N--CA 1.5 2.047 0 N-CA-C 115.681 1.734 . . . . 0.0 115.681 -179.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LYS . . . . . 0.479 ' HA ' ' C ' ' A' ' 42' ' ' THR . 49.4 mmtm 19.78 57.22 0.02 OUTLIER 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 118.103 2.631 . . . . 0.0 118.103 179.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.421 HG21 ' SG ' ' A' ' 24' ' ' CYS . 3.6 m -111.06 142.89 27.21 Favored Pre-proline 0 N--CA 1.504 2.264 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 179.48 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PRO . . . . . . . . . . . . . 27.8 Cg_endo -79.21 69.92 7.72 Favored 'Trans proline' 0 C--N 1.314 -1.242 0 C-N-CA 122.917 2.411 . . . . 0.0 107.705 -178.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' VAL . . . . . . . . . . . . . 62.0 t -24.63 146.04 0.0 OUTLIER 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 N-CA-C 115.747 1.758 . . . . 0.0 115.747 -179.739 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' GLU . . . . . . . . . . . . . 36.3 tt0 -112.37 -65.18 1.2 Allowed 'General case' 0 N--CA 1.489 1.499 0 CA-C-N 113.12 -1.855 . . . . 0.0 111.501 -179.594 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.7 m -133.98 169.25 17.4 Favored 'General case' 0 N--CA 1.497 1.923 0 N-CA-C 114.354 1.242 . . . . 0.0 114.354 -179.683 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' VAL . . . . . . . . . . . . . 3.3 m -130.2 131.86 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.698 0 N-CA-C 105.583 -2.006 . . . . 0.0 105.583 179.043 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 7.5 p -116.01 139.18 43.8 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.669 0 N-CA-C 104.581 -2.378 . . . . 0.0 104.581 179.892 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' HIS . . . . . 0.43 ' HB3' ' CE1' ' A' ' 30' ' ' TYR . 1.5 p80 -118.53 87.74 2.79 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 125.205 1.566 . . . . 0.0 110.282 -179.686 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' THR . . . . . . . . . . . . . 61.9 m -94.64 72.77 3.67 Favored 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 104.366 -2.457 . . . . 0.0 104.366 179.997 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ILE . . . . . 0.462 HG12 ' H ' ' A' ' 18' ' ' TYR . 39.1 mt -105.78 170.45 2.16 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.771 0 CA-C-N 111.86 -2.427 . . . . 0.0 106.309 -179.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -114.3 -176.19 2.85 Favored 'General case' 0 N--CA 1.499 1.987 0 N-CA-C 113.7 1.0 . . . . 0.0 113.7 -179.719 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' SER . . . . . . . . . . . . . 53.9 m 4.22 75.75 0.0 OUTLIER 'General case' 0 N--CA 1.5 2.057 0 N-CA-C 117.187 2.291 . . . . 0.0 117.187 179.812 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.407 ' O ' ' CB ' ' A' ' 61' ' ' SER . 1.7 p30 -115.35 167.72 10.61 Favored 'General case' 0 N--CA 1.499 1.992 0 CA-C-N 114.459 -1.246 . . . . 0.0 109.017 179.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' SER . . . . . 0.407 ' CB ' ' O ' ' A' ' 60' ' ' ASP . 50.4 p 137.09 83.1 0.0 OUTLIER 'General case' 0 N--CA 1.513 2.713 0 O-C-N 125.623 1.827 . . . . 0.0 107.888 -179.754 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 4.0 mm-40 -105.73 179.65 4.21 Favored 'General case' 0 N--CA 1.5 2.041 0 CA-C-N 114.832 -1.076 . . . . 0.0 110.359 -179.714 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 64.39 179.12 0.17 Allowed 'General case' 0 N--CA 1.504 2.232 0 O-C-N 124.63 1.206 . . . . 0.0 112.806 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' GLY . . . . . . . . . . . . . . . -118.21 -59.4 0.28 Allowed Glycine 0 N--CA 1.495 2.627 0 N-CA-C 108.197 -1.961 . . . . 0.0 108.197 179.975 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -118.36 -142.84 0.36 Allowed 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 105.792 -1.929 . . . . 0.0 105.792 179.907 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 6.1 pm0 -106.14 -35.29 7.26 Favored 'General case' 0 N--CA 1.5 2.044 0 O-C-N 123.068 0.23 . . . . 0.0 111.1 -179.984 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' LEU . . . . . . . . . . . . . 79.8 mt -115.3 -44.36 3.0 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 123.838 0.711 . . . . 0.0 111.239 -179.841 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' ILE . . . . . 0.688 HD13 ' H ' ' A' ' 68' ' ' ILE . 0.2 OUTLIER . . . . . 0 N--CA 1.502 2.145 0 CA-C-O 117.314 -1.327 . . . . 0.0 112.039 -179.881 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' ' ZN' . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . . 0 0 . 1 stop_ save_