data_1uua_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 1uua _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 120.55 0.214 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.466 ' HB2' ' HA ' ' A' ' 41' ' ' ASN . 0.4 OUTLIER -129.7 52.03 2.03 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.376 0.608 . . . . 0.0 111.314 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.0 t -128.93 -51.07 1.22 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.733 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -100.58 8.44 43.44 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 123.47 0.481 . . . . 0.0 112.135 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.456 ' HB2' ' OD1' ' A' ' 41' ' ' ASN . 55.3 mm-40 -89.87 141.2 28.01 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.121 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 4.2 Cg_exo -75.7 159.37 38.88 Favored 'Trans proline' 0 C--N 1.369 1.613 0 C-N-CA 123.107 2.538 . . . . 0.0 113.085 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.56 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 58.7 Cg_endo -63.1 148.12 93.62 Favored 'Trans proline' 0 C--N 1.37 1.709 0 C-N-CA 123.518 2.812 . . . . 0.0 113.619 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -107.8 45.9 0.98 Allowed 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.39 0.614 . . . . 0.0 110.83 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.625 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 21.8 m -54.17 -48.25 71.11 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.755 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 54.66 -150.89 16.19 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-O 119.291 -0.727 . . . . 0.0 113.22 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -87.84 15.74 2.06 Favored 'Trans proline' 0 C--N 1.366 1.45 0 C-N-CA 122.968 2.446 . . . . 0.0 113.344 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -140.87 120.17 13.03 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.422 0.289 . . . . 0.0 111.541 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.745 ' HE2' ' HA ' ' A' ' 33' ' ' TYR . 2.1 tptm -179.16 108.28 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.969 1.308 . . . . 0.0 108.114 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.462 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -76.66 -141.82 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.881 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.45 46.1 0.93 Allowed 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.534 ' O ' HG11 ' A' ' 32' ' ' VAL . 19.0 mt -129.0 90.59 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 1.031 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.2 mp -76.5 144.67 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-O 121.73 0.776 . . . . 0.0 110.58 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.723 ' HG2' ' HA ' ' A' ' 44' ' ' LYS . 4.8 ttt180 -134.2 -160.32 1.04 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 113.633 -1.621 . . . . 0.0 110.237 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -132.78 147.24 52.31 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.648 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 6.2 p90 -144.97 141.94 29.39 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.561 ' CE2' ' HG2' ' A' ' 50' ' ' MET . 17.3 t80 -84.47 120.7 26.61 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.747 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 0.7 OUTLIER -97.0 95.85 8.09 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.362 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.88 -14.17 0.19 Allowed 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -178.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -95.91 -26.66 15.51 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 117.536 0.153 . . . . 0.0 111.214 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.747 ' HB3' ' HB2' ' A' ' 22' ' ' ASN . . . -85.1 -44.84 12.64 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.515 0.509 . . . . 0.0 111.689 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.69 -8.34 25.95 Favored Glycine 0 C--N 1.343 0.923 0 C-N-CA 121.25 -0.5 . . . . 0.0 113.495 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.597 HD11 ' N ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -141.56 175.31 9.78 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.947 0.374 . . . . 0.0 111.708 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 94.4 m -94.42 102.89 14.87 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.635 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.5 tp60 -79.76 148.36 31.5 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.644 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 40.7 p -78.41 121.95 25.18 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.691 ' O ' ' N ' ' A' ' 18' ' ' ARG . 5.5 p90 -138.83 154.03 48.41 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 114.195 -1.366 . . . . 0.0 108.253 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 1.031 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 14.3 t -76.94 163.7 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 CA-C-N 118.508 0.595 . . . . 0.0 112.407 -178.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.745 ' HA ' ' HE2' ' A' ' 13' ' ' LYS . 55.3 t80 -117.5 146.54 43.47 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.099 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -119.12 151.16 17.72 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 120.996 -0.621 . . . . 0.0 113.213 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.16 -15.01 46.36 Favored Glycine 0 C--N 1.339 0.702 0 O-C-N 123.86 0.388 . . . . 0.0 112.733 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.94 -34.85 17.97 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 122.704 0.402 . . . . 0.0 111.693 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -97.34 -72.06 0.66 Allowed 'General case' 0 CA--C 1.536 0.411 0 O-C-N 123.233 0.333 . . . . 0.0 110.443 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 47.55 117.95 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.581 1.152 . . . . 0.0 113.888 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -131.74 -173.17 3.06 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.26 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -75.53 -47.81 25.26 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.448 -177.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.598 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.2 OUTLIER -69.98 76.57 0.48 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.217 0.532 . . . . 0.0 111.627 -179.523 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -154.74 128.51 8.69 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.095 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.54 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 56.9 m-85 -129.97 135.21 48.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.137 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.723 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 3.2 tppp? -80.1 -38.89 30.73 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 123.267 0.354 . . . . 0.0 111.872 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.8 m -111.87 138.53 48.35 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 123.234 0.334 . . . . 0.0 111.661 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.63 -31.62 72.85 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.709 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.4 mp0 -63.56 -56.9 12.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.347 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -68.75 -24.13 64.41 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.156 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.54 ' HA ' ' CD2' ' A' ' 43' ' ' PHE . 43.4 t -66.81 -54.86 18.2 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.659 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.561 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 96.7 mtp -73.26 -30.36 63.39 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.091 0.557 . . . . 0.0 112.218 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -74.0 -37.68 64.34 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 123.282 0.364 . . . . 0.0 111.693 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.401 ' HB ' ' CE2' ' A' ' 43' ' ' PHE . 20.4 m -85.91 -33.81 21.11 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 123.129 0.268 . . . . 0.0 111.436 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -87.02 -50.11 6.87 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 121.24 -0.184 . . . . 0.0 110.565 179.928 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.856 0 O-C-N 123.443 0.464 . . . . 0.0 112.547 -179.91 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.549 0.214 . . . . 0.0 111.119 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -104.85 -161.13 0.8 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.049 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.436 ' O ' ' HD2' ' A' ' 21' ' ' TYR . 42.2 t 73.82 -47.26 0.65 Allowed 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.443 1.097 . . . . 0.0 111.826 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -98.78 -12.86 20.5 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 123.188 0.305 . . . . 0.0 111.571 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 5.8 mm-40 -97.85 147.9 33.71 Favored Pre-proline 0 CA--C 1.537 0.446 0 O-C-N 123.258 0.349 . . . . 0.0 111.04 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 3.7 Cg_exo -78.04 165.13 26.54 Favored 'Trans proline' 0 C--N 1.369 1.631 0 C-N-CA 123.264 2.643 . . . . 0.0 112.949 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.552 ' HD3' ' CD1' ' A' ' 20' ' ' PHE . 50.0 Cg_endo -60.48 161.1 21.58 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 123.492 2.795 . . . . 0.0 113.085 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.448 ' CE2' ' HD2' ' A' ' 37' ' ' ARG . 10.3 t80 -125.83 36.27 4.56 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.45 ' OG1' ' HD2' ' A' ' 31' ' ' PHE . 11.8 m -62.04 -47.79 83.16 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 178.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.37 -161.03 53.51 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.704 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.46 42.1 1.19 Allowed 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 123.067 2.511 . . . . 0.0 112.572 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.4 m -92.35 -66.12 0.95 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.466 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? 66.03 98.18 0.05 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.016 0.927 . . . . 0.0 111.571 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.403 ' HB2' HH21 ' A' ' 15' ' ' ARG . . . -119.03 -175.05 2.83 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.535 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.797 ' H ' ' HE ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -109.0 38.24 2.34 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.163 0.506 . . . . 0.0 111.866 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 16.2 mt -138.52 71.41 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.384 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 1.066 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 13.1 tt -75.06 117.32 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-O 122.403 1.097 . . . . 0.0 111.48 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.761 ' N ' ' O ' ' A' ' 31' ' ' PHE . 54.4 mtt180 -100.28 -159.22 0.72 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 112.668 -2.06 . . . . 0.0 109.818 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.43 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 10.2 m-85 -125.5 164.23 20.95 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.736 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 7.1 p90 -158.13 164.31 36.74 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.894 -1.048 . . . . 0.0 108.994 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.631 ' HD1' ' SG ' ' A' ' 28' ' ' CYS . 63.1 t80 -108.9 110.28 21.56 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.62 HD22 ' HB2' ' A' ' 29' ' ' GLN . 0.2 OUTLIER -77.53 83.48 3.93 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.489 0.661 . . . . 0.0 109.916 -179.418 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.31 -2.62 1.05 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.213 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -96.95 -38.07 9.95 Favored 'General case' 0 C--N 1.346 0.452 0 C-N-CA 122.359 0.263 . . . . 0.0 110.763 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -87.04 -56.01 3.57 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.016 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 153.56 -55.81 0.43 Allowed Glycine 0 C--N 1.343 0.929 0 C-N-CA 121.295 -0.478 . . . . 0.0 112.453 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 pp -96.74 -175.16 3.21 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -178.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.631 ' SG ' ' HD1' ' A' ' 21' ' ' TYR . 89.1 m -98.67 139.62 34.1 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.271 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.62 ' HB2' HD22 ' A' ' 22' ' ' ASN . 0.1 OUTLIER -123.38 153.64 40.09 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 123.263 0.352 . . . . 0.0 110.625 -179.713 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.679 ' HB ' HG12 ' A' ' 17' ' ' ILE . 40.4 p -85.36 120.0 26.35 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.761 ' O ' ' N ' ' A' ' 18' ' ' ARG . 4.1 p90 -108.77 163.3 13.39 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 114.263 -1.335 . . . . 0.0 107.421 177.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 1.066 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 41.0 t -104.39 144.25 14.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 119.546 1.066 . . . . 0.0 109.71 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.567 ' HB2' ' HD2' ' A' ' 18' ' ' ARG . 39.0 t80 -115.07 124.66 52.15 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.007 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -125.45 -168.29 12.69 Favored Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.581 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -97.28 23.9 33.79 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 121.353 -0.451 . . . . 0.0 112.936 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 21.6 p -95.5 -44.05 7.69 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.281 0.233 . . . . 0.0 111.055 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.448 ' HD2' ' CE2' ' A' ' 8' ' ' TYR . 40.2 mmt180 -133.4 169.68 16.59 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.897 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -158.66 120.96 3.6 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.031 0.532 . . . . 0.0 110.084 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.409 ' CD ' ' H ' ' A' ' 40' ' ' ARG . 4.4 mmtp -141.65 -169.1 2.82 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.326 0.584 . . . . 0.0 112.082 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.409 ' H ' ' CD ' ' A' ' 39' ' ' LYS . 24.8 mmm180 -76.23 -67.61 0.67 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.93 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.46 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.4 OUTLIER -44.9 99.6 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -178.448 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.504 ' ND2' HH11 ' A' ' 18' ' ' ARG . 7.5 m120 -151.37 139.28 19.95 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.947 178.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.736 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 97.7 m-85 -142.71 147.71 36.09 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.588 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -96.71 -44.04 7.28 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.643 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.4 m -133.9 165.07 25.85 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.416 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -62.36 -69.58 0.25 Allowed 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.052 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.483 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 67.7 tt0 -51.52 -37.01 47.27 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.813 0.445 . . . . 0.0 111.283 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.0 -34.0 74.56 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.462 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.649 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 33.8 t -65.93 -46.19 79.15 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.005 178.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.448 ' SD ' ' SG ' ' A' ' 28' ' ' CYS . 1.4 mpt? -64.75 -52.29 57.77 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.931 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 46.0 ptt85 -64.34 -37.16 86.53 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -178.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 25.5 m -80.38 -31.52 37.76 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.588 ' SG ' ' CD2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -88.41 -63.18 1.34 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 119.454 -0.307 . . . . 0.0 111.502 -179.616 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.455 ' N ' ' SG ' ' A' ' 53' ' ' CYS . . . . . . . . 0 C--N 1.347 1.148 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.553 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.476 0.179 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -96.14 7.74 45.62 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.028 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.412 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 46.9 t -84.05 -24.0 30.61 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.008 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.481 ' HA ' ' CB ' ' A' ' 23' ' ' ALA . 4.1 mm? -116.86 -12.53 10.75 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.651 0.594 . . . . 0.0 111.471 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.407 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 5.8 mm-40 -96.52 144.37 27.73 Favored Pre-proline 0 N--CA 1.468 0.43 0 O-C-N 123.287 0.367 . . . . 0.0 111.154 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 4.9 Cg_exo -78.7 163.18 26.67 Favored 'Trans proline' 0 C--N 1.369 1.642 0 C-N-CA 123.293 2.662 . . . . 0.0 113.052 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.497 ' HD3' ' CE1' ' A' ' 20' ' ' PHE . 62.6 Cg_endo -64.25 168.84 11.83 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 123.498 2.798 . . . . 0.0 113.084 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.519 ' CZ ' ' HD3' ' A' ' 37' ' ' ARG . 7.2 t80 -129.27 1.16 5.15 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.3 m -44.22 -13.05 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.445 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . 49.46 -146.21 7.27 Favored Glycine 0 CA--C 1.535 1.327 0 N-CA-C 114.657 0.623 . . . . 0.0 114.657 177.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -83.43 4.72 6.84 Favored 'Trans proline' 0 C--N 1.37 1.698 0 C-N-CA 123.405 2.737 . . . . 0.0 113.487 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.4 136.61 33.79 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.1 82.74 2.04 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.867 -1.06 . . . . 0.0 109.798 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.828 ' HB2' HH21 ' A' ' 15' ' ' ARG . . . -78.57 -161.16 0.26 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.367 -1.288 . . . . 0.0 111.094 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.828 HH21 ' HB2' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -120.84 39.37 3.8 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.188 0.518 . . . . 0.0 111.358 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.535 ' HB ' ' O ' ' A' ' 33' ' ' TYR . 24.5 mt -134.97 75.66 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.061 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 1.037 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 21.2 mm -55.83 144.78 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 123.692 0.797 . . . . 0.0 110.837 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.532 HH12 ' HE3' ' A' ' 44' ' ' LYS . 14.4 mmt180 -149.11 171.63 16.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 113.679 -1.601 . . . . 0.0 110.166 -177.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.463 ' C ' ' HB2' ' A' ' 43' ' ' PHE . 4.3 m-85 -117.63 155.76 29.32 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 121.261 -0.176 . . . . 0.0 111.237 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.806 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 1.0 OUTLIER -146.68 152.86 39.55 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 123.643 0.589 . . . . 0.0 110.112 178.797 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.507 ' HB2' ' SG ' ' A' ' 49' ' ' CYS . 30.3 t80 -100.43 132.94 45.54 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.586 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -95.31 127.11 41.09 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.128 -0.694 . . . . 0.0 109.128 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.481 ' CB ' ' HA ' ' A' ' 4' ' ' LEU . . . -94.59 14.15 21.87 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.603 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -97.03 -23.1 16.43 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -136.77 -23.25 1.2 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.264 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 97.69 -7.79 63.45 Favored Glycine 0 C--N 1.346 1.106 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.106 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.463 ' HA ' ' HE2' ' A' ' 50' ' ' MET . 3.4 pp -87.31 144.8 26.62 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 122.757 0.423 . . . . 0.0 111.759 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.485 ' H ' ' HE3' ' A' ' 50' ' ' MET . 78.3 m -92.19 142.3 27.64 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.832 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.522 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 2.5 tm0? -124.22 145.58 49.26 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.185 0.516 . . . . 0.0 111.835 -178.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.411 HG23 ' CZ ' ' A' ' 19' ' ' TYR . 39.8 p -85.4 143.11 28.81 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.509 -1.223 . . . . 0.0 111.826 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.547 ' CZ ' ' HB3' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -165.13 176.13 8.76 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.9 178.343 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 1.037 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 1.3 t -92.77 -162.07 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 124.32 1.048 . . . . 0.0 111.141 -178.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.691 ' HH ' ' HB1' ' A' ' 38' ' ' ALA . 65.4 t80 -174.33 144.15 0.91 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.631 1.173 . . . . 0.0 109.037 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.89 -160.55 9.59 Favored Glycine 0 C--N 1.337 0.602 0 C-N-CA 120.962 -0.637 . . . . 0.0 113.225 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -94.77 15.05 64.18 Favored Glycine 0 C--N 1.338 0.693 0 O-C-N 123.781 0.342 . . . . 0.0 113.406 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -48.03 7.47 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.519 ' HD3' ' CZ ' ' A' ' 8' ' ' TYR . 2.6 mmp_? -135.49 119.54 17.55 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.021 0.439 . . . . 0.0 111.498 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.691 ' HB1' ' HH ' ' A' ' 33' ' ' TYR . . . -118.46 119.38 34.4 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.635 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -124.43 -114.87 0.29 Allowed 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.824 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -142.39 -33.37 0.48 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 122.657 0.383 . . . . 0.0 111.306 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.477 ' ND2' ' HB2' ' A' ' 20' ' ' PHE . 0.4 OUTLIER -66.62 101.38 0.78 Allowed 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.696 0.76 . . . . 0.0 111.45 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -146.38 150.57 35.93 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 114.343 -1.299 . . . . 0.0 109.61 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.806 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 64.6 m-85 -153.36 165.35 36.05 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.811 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.532 ' HE3' HH12 ' A' ' 18' ' ' ARG . 13.8 mptt -99.02 -54.82 2.88 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.701 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.6 m -143.71 170.6 15.56 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.724 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.87 -46.79 87.9 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -52.17 -60.57 3.05 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.069 0.548 . . . . 0.0 110.941 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 52' ' ' THR . 49.0 m-20 -59.55 -53.44 58.11 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.316 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.634 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 28.5 t -40.28 -48.25 2.6 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.546 0.738 . . . . 0.0 111.961 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.485 ' HE3' ' H ' ' A' ' 28' ' ' CYS . 25.6 mmt -67.59 -47.11 70.68 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.854 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -79.3 -9.55 59.61 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 48' ' ' ASP . 40.2 m -91.67 -45.38 8.49 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.264 0.225 . . . . 0.0 110.586 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.64 -43.72 8.16 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 123.159 0.287 . . . . 0.0 110.802 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.043 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.716 179.968 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 120.55 0.214 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.4 ' HE1' ' HZ ' ' A' ' 43' ' ' PHE . 2.2 p90 -124.91 -167.22 1.64 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.17 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.529 ' SG ' ' HB3' ' A' ' 21' ' ' TYR . 6.6 t 72.1 -36.24 0.35 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.728 1.211 . . . . 0.0 112.552 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.729 HD13 ' HB3' ' A' ' 23' ' ' ALA . 13.7 tp -80.05 -10.4 59.77 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 123.419 0.45 . . . . 0.0 111.844 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -95.75 152.59 39.18 Favored Pre-proline 0 CA--C 1.536 0.435 0 O-C-N 123.395 0.435 . . . . 0.0 110.374 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.92 149.46 90.13 Favored 'Trans proline' 0 C--N 1.368 1.602 0 C-N-CA 122.603 2.202 . . . . 0.0 113.166 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.434 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 31.1 Cg_endo -55.71 138.21 80.57 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 123.648 2.899 . . . . 0.0 113.476 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.571 ' O ' ' N ' ' A' ' 10' ' ' GLY . 1.6 t80 -91.18 8.11 37.36 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.568 0.543 . . . . 0.0 111.861 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 32' ' ' VAL . 10.6 m -30.04 -18.99 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 -178.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.571 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 5.86 110.91 0.0 OUTLIER Glycine 0 C--N 1.358 1.762 0 CA-C-O 118.41 -1.217 . . . . 0.0 114.488 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -23.06 87.1 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 124.953 3.769 . . . . 0.0 115.559 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.9 m -129.9 -157.49 0.82 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.283 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -98.6 71.61 1.98 Allowed 'General case' 0 C--O 1.239 0.543 0 CA-C-O 122.209 1.004 . . . . 0.0 108.318 178.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.852 ' HB1' HG13 ' A' ' 32' ' ' VAL . . . -100.16 128.02 46.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 113.688 -1.596 . . . . 0.0 111.82 -179.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.74 20.78 2.34 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.832 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.2 mt -137.21 105.1 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.877 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.927 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 9.1 tt -81.44 134.72 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 121.545 0.688 . . . . 0.0 110.26 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.794 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 57.7 mtt180 -128.44 -176.92 3.97 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.864 -1.516 . . . . 0.0 111.105 -177.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.556 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.8 m-85 -122.83 148.55 45.26 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.434 ' CE2' ' HD3' ' A' ' 7' ' ' PRO . 8.9 p90 -144.3 150.6 38.12 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.357 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.657 ' HE1' ' HA3' ' A' ' 26' ' ' GLY . 3.7 t80 -86.56 125.3 33.69 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -97.4 121.94 39.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.729 ' HB3' HD13 ' A' ' 4' ' ' LEU . . . -80.36 5.26 15.39 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -96.55 -16.57 21.0 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.873 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.931 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -128.09 -39.36 1.74 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.106 -179.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.657 ' HA3' ' HE1' ' A' ' 21' ' ' TYR . . . 114.12 -42.4 1.94 Allowed Glycine 0 C--N 1.343 0.934 0 C-N-CA 121.416 -0.421 . . . . 0.0 112.317 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.931 HD22 ' HB1' ' A' ' 25' ' ' ALA . 0.8 OUTLIER -77.1 169.6 18.04 Favored 'General case' 0 C--O 1.243 0.754 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -179.127 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.7 m -96.05 136.14 36.9 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.167 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.556 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 38.1 mt-30 -106.15 156.17 18.71 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 123.746 0.654 . . . . 0.0 111.652 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.513 HG23 ' CE1' ' A' ' 19' ' ' TYR . 47.8 p -92.26 129.44 38.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.398 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.467 ' C ' HG13 ' A' ' 17' ' ' ILE . 3.1 p90 -142.83 138.76 30.56 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.423 -0.808 . . . . 0.0 108.968 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.927 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 26.0 t -88.7 103.79 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 122.889 0.475 . . . . 0.0 111.74 -178.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -68.08 146.19 53.71 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.367 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -120.31 153.24 16.76 Favored Glycine 0 C--N 1.336 0.556 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.01 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -98.79 44.64 1.7 Allowed Glycine 0 C--N 1.336 0.575 0 C-N-CA 121.254 -0.498 . . . . 0.0 113.103 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.5 p -95.7 -36.18 11.29 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -128.17 -67.57 0.8 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 123.311 0.382 . . . . 0.0 111.394 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 96.36 132.91 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.093 1.357 . . . . 0.0 110.056 -178.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -129.16 -112.17 0.27 Allowed 'General case' 0 CA--C 1.548 0.897 0 O-C-N 123.563 0.539 . . . . 0.0 111.772 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -151.67 -35.42 0.13 Allowed 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.504 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.3 OUTLIER -76.96 94.71 4.0 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.087 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.794 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 9.7 m120 -157.86 125.01 5.05 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.501 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.541 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 82.1 m-85 -132.51 101.54 5.36 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -65.51 -13.29 58.57 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.3 m -131.07 140.3 50.02 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.638 0.256 . . . . 0.0 111.271 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.74 -48.0 76.2 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.13 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -47.72 -59.16 3.5 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 124.008 0.818 . . . . 0.0 110.281 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -63.68 -36.74 84.86 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.625 0.37 . . . . 0.0 111.18 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.705 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 51.0 t -56.41 -60.48 3.46 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 123.594 0.558 . . . . 0.0 110.758 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.0 mtt -63.56 -36.89 85.3 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.5 ttt85 -67.39 -38.46 84.74 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 16.9 m -79.07 -49.72 12.21 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 122.879 0.112 . . . . 0.0 111.084 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.705 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -80.92 -58.59 3.02 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.653 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.107 0 C-N-CA 120.906 -0.664 . . . . 0.0 113.23 -179.598 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.503 0.192 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -123.64 -148.44 0.4 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.197 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.472 ' SG ' ' HB3' ' A' ' 21' ' ' TYR . 34.0 t 70.45 -14.06 0.43 Allowed 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 124.299 1.039 . . . . 0.0 112.638 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.456 HD11 ' CE2' ' A' ' 21' ' ' TYR . 19.1 tp -92.93 42.7 1.11 Allowed 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.533 0.682 . . . . 0.0 111.088 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.725 ' HB3' ' HZ2' ' A' ' 39' ' ' LYS . 61.1 mp0 -129.98 144.92 55.03 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.966 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -71.45 153.88 60.68 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 122.887 2.391 . . . . 0.0 112.804 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.41 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 36.4 Cg_endo -57.83 133.7 57.82 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 123.458 2.772 . . . . 0.0 113.265 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -105.17 13.27 30.92 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.01 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.508 HG23 ' O ' ' A' ' 12' ' ' CYS . 7.1 m -46.01 -24.15 0.39 Allowed 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.412 0.685 . . . . 0.0 112.702 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 53.47 -141.53 30.98 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-O 119.482 -0.621 . . . . 0.0 114.351 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.412 ' HD2' ' HE ' ' A' ' 37' ' ' ARG . 6.3 Cg_exo -79.25 -4.48 13.79 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 123.296 2.664 . . . . 0.0 113.218 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.508 ' O ' HG23 ' A' ' 9' ' ' THR . 0.1 OUTLIER -86.01 141.27 29.61 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 179.712 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.01 85.93 2.21 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.647 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.01 -167.51 1.03 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 114.569 -1.196 . . . . 0.0 111.498 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.688 ' H ' ' HD3' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -119.43 34.34 5.26 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 121.178 0.513 . . . . 0.0 111.45 -179.073 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.3 mt -132.29 78.36 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.44 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 1.016 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.0 mp -65.28 145.9 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-O 121.454 0.645 . . . . 0.0 109.669 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.717 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 65.4 mtt180 -148.19 168.81 21.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.726 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.484 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.6 m-85 -112.85 148.4 34.98 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.585 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 4.8 p90 -141.49 152.77 44.47 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.449 1.093 . . . . 0.0 109.435 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.554 ' HE1' ' HA3' ' A' ' 26' ' ' GLY . 7.5 t80 -83.68 144.45 29.38 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -123.07 122.38 38.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.408 ' HB3' HD12 ' A' ' 4' ' ' LEU . . . -79.75 10.57 3.94 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.686 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -96.56 -22.25 17.18 Favored 'General case' 0 C--N 1.346 0.444 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.949 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -133.0 -11.6 2.93 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.075 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.554 ' HA3' ' HE1' ' A' ' 21' ' ' TYR . . . 86.8 -39.63 3.09 Favored Glycine 0 C--N 1.345 1.047 0 C-N-CA 121.555 -0.355 . . . . 0.0 113.291 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.949 HD22 ' HB1' ' A' ' 25' ' ' ALA . 0.4 OUTLIER -76.51 178.25 6.78 Favored 'General case' 0 C--O 1.244 0.8 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.429 ' H ' ' HE1' ' A' ' 50' ' ' MET . 89.3 m -102.27 151.01 22.73 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.985 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.585 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 53.7 tp60 -116.45 158.62 23.26 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.716 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.414 HG21 ' CE1' ' A' ' 19' ' ' TYR . 39.9 p -94.0 126.49 39.25 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.791 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.514 ' O ' ' N ' ' A' ' 18' ' ' ARG . 2.7 p90 -145.18 140.29 27.82 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.055 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 1.016 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -89.08 101.26 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 C-N-CA 123.45 0.7 . . . . 0.0 112.526 -178.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.499 ' HH ' ' HA ' ' A' ' 38' ' ' ALA . 77.5 t80 -73.71 148.54 42.57 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.234 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -140.78 -172.97 13.23 Favored Glycine 0 C--N 1.338 0.641 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.34 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -94.5 1.58 66.68 Favored Glycine 0 C--N 1.34 0.767 0 O-C-N 123.767 0.334 . . . . 0.0 113.266 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -37.71 19.28 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.412 ' HE ' ' HD2' ' A' ' 11' ' ' PRO . 88.6 mtt-85 -137.05 111.85 8.82 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.936 0.398 . . . . 0.0 111.101 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.499 ' HA ' ' HH ' ' A' ' 33' ' ' TYR . . . -93.85 144.01 25.82 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.918 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.725 ' HZ2' ' HB3' ' A' ' 5' ' ' GLU . 4.6 tmtp? -134.78 -128.04 0.16 Allowed 'General case' 0 CA--C 1.55 0.946 0 O-C-N 123.464 0.477 . . . . 0.0 110.744 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 78.2 mtm180 -144.28 -32.38 0.43 Allowed 'General case' 0 C--N 1.351 0.667 0 CA-C-N 118.185 0.448 . . . . 0.0 112.146 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -89.43 102.02 14.7 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.416 0.627 . . . . 0.0 111.363 -179.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.717 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 69.7 m-80 -144.64 116.92 8.46 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.862 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.546 ' HZ ' HG23 ' A' ' 52' ' ' THR . 70.3 m-85 -138.79 108.06 6.1 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.528 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -62.97 -16.81 60.9 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 60.0 p -130.98 136.68 48.76 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 120.731 0.3 . . . . 0.0 111.28 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.83 -43.12 98.69 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.444 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -48.6 -61.75 1.86 Allowed 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.857 0.723 . . . . 0.0 110.908 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -61.8 -38.24 87.38 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 122.433 0.293 . . . . 0.0 111.176 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.489 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 47.0 t -54.49 -60.04 3.88 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 123.653 0.596 . . . . 0.0 110.754 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.429 ' HE1' ' H ' ' A' ' 28' ' ' CYS . 68.4 mtt -60.98 -40.5 93.69 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.061 0.545 . . . . 0.0 112.103 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -65.23 -30.72 71.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.546 HG23 ' HZ ' ' A' ' 43' ' ' PHE . 21.3 m -82.46 -50.3 9.01 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 122.921 0.138 . . . . 0.0 110.848 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -86.98 -58.98 2.39 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.869 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.464 -179.761 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 45.4 p30 . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 120.493 0.187 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -124.33 175.01 7.35 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.402 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.576 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 11.7 t 70.5 -15.67 0.35 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 124.48 1.112 . . . . 0.0 113.193 179.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.698 HD23 ' HE2' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -79.5 -14.25 59.0 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.429 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -100.41 155.66 36.12 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.198 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.21 165.28 5.61 Favored 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 122.809 2.339 . . . . 0.0 112.827 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.544 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 28.9 Cg_endo -55.3 134.17 62.29 Favored 'Trans proline' 0 C--N 1.376 1.98 0 C-N-CA 123.318 2.679 . . . . 0.0 113.172 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.557 ' HD2' ' HB3' ' A' ' 39' ' ' LYS . 3.6 t80 -87.1 22.02 2.18 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 123.505 0.503 . . . . 0.0 112.057 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.81 HG22 HG13 ' A' ' 32' ' ' VAL . 20.2 m -50.17 -31.38 13.48 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.076 0.55 . . . . 0.0 111.287 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 37.87 -133.29 1.25 Allowed Glycine 0 C--N 1.352 1.454 0 O-C-N 124.126 0.891 . . . . 0.0 114.026 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -83.32 3.93 7.41 Favored 'Trans proline' 0 C--N 1.366 1.486 0 C-N-CA 123.062 2.508 . . . . 0.0 112.51 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.487 ' O ' HG21 ' A' ' 9' ' ' THR . 2.7 m -97.27 140.96 30.97 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.16 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.727 ' HZ1' ' HB3' ' A' ' 13' ' ' LYS . 3.9 mmmp? -148.58 85.87 1.51 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.261 0.553 . . . . 0.0 110.444 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.36 -171.4 2.93 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.999 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.19 35.82 3.13 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.158 0.504 . . . . 0.0 112.035 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.48 ' O ' HG21 ' A' ' 32' ' ' VAL . 17.4 mt -135.11 95.01 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.566 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 1.031 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.9 mp -93.87 138.86 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 121.74 0.781 . . . . 0.0 110.017 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.754 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 31.6 mtt180 -127.38 -153.19 0.55 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 113.497 -1.683 . . . . 0.0 109.546 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.624 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 3.4 m-85 -116.4 170.7 8.35 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.509 0.595 . . . . 0.0 112.262 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.633 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 9.3 p90 -159.52 167.76 27.82 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.571 1.169 . . . . 0.0 110.362 176.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.698 ' HE2' HD23 ' A' ' 4' ' ' LEU . 5.2 t80 -106.65 102.05 11.46 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.43 86.48 3.81 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.717 0.77 . . . . 0.0 109.095 178.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.551 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . . . -71.12 0.73 7.03 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.605 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.8 ttpt -95.02 -34.15 12.45 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.32 -49.01 6.16 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.17 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 145.38 -57.76 0.52 Allowed Glycine 0 C--N 1.343 0.963 0 O-C-N 123.452 0.47 . . . . 0.0 112.853 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 pp -89.88 -175.4 4.59 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.3 m -99.59 136.76 39.05 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.666 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.633 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 20.9 tt0 -111.05 -151.29 0.48 Allowed 'General case' 0 C--O 1.243 0.744 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.624 ' HA ' ' HA ' ' A' ' 19' ' ' TYR . 34.1 p -138.69 135.35 34.72 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-N 118.789 0.722 . . . . 0.0 111.468 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.719 ' O ' ' N ' ' A' ' 18' ' ' ARG . 1.3 p90 -133.87 165.55 24.73 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.777 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 1.031 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.2 p -78.16 -163.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 C-N-CA 123.398 0.679 . . . . 0.0 111.533 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.421 ' H ' ' CG2' ' A' ' 32' ' ' VAL . 64.7 t80 -169.31 113.37 0.53 Allowed 'General case' 0 C--O 1.238 0.45 0 C-N-CA 124.145 0.978 . . . . 0.0 108.983 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -117.87 160.65 13.66 Favored Glycine 0 C--N 1.334 0.424 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.585 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -88.25 44.75 3.22 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 121.487 -0.387 . . . . 0.0 112.368 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.5 p -95.27 -49.15 5.6 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.478 0.311 . . . . 0.0 111.207 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -130.99 -37.34 1.29 Allowed 'General case' 0 N--CA 1.467 0.42 0 O-C-N 123.288 0.368 . . . . 0.0 111.485 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 53.86 113.65 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.123 0.969 . . . . 0.0 112.861 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.557 ' HB3' ' HD2' ' A' ' 8' ' ' TYR . 5.0 pttt -124.75 166.13 16.73 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.804 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -83.34 57.45 4.0 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.511 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.3 OUTLIER -148.58 92.82 2.05 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.664 178.632 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.754 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 9.1 m120 -156.9 143.97 18.69 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.2 178.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.478 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 31.3 m-85 -136.65 147.21 46.74 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -96.76 -43.38 7.55 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.576 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.6 m -127.46 158.63 36.86 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.44 -59.6 3.83 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.778 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -48.62 -39.96 25.93 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.317 0.647 . . . . 0.0 111.64 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -74.43 -34.87 63.34 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.997 178.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.473 ' HA ' ' CD2' ' A' ' 43' ' ' PHE . 45.2 t -67.75 -23.74 65.27 Favored 'General case' 0 C--N 1.349 0.556 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.692 177.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.582 ' HA ' ' HA2' ' A' ' 54' ' ' GLY . 94.3 mtp -83.71 -51.86 6.9 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -49.18 -38.47 25.95 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.057 179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.403 ' HB ' ' CZ ' ' A' ' 43' ' ' PHE . 7.2 m -92.5 -49.78 5.95 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.187 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.594 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 1.6 p -128.34 65.25 1.4 Allowed 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.582 ' HA2' ' HA ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.337 0.614 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.438 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.583 0.23 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -119.65 175.5 5.83 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.361 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.577 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 22.9 t 71.6 -37.31 0.39 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.647 1.179 . . . . 0.0 112.955 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 mp -82.71 -10.61 58.83 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -90.72 157.04 44.46 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.659 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -57.8 143.19 96.01 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.79 2.327 . . . . 0.0 113.181 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.52 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 39.8 Cg_endo -59.14 128.6 28.26 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 123.468 2.779 . . . . 0.0 113.824 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.652 ' HE2' ' HD3' ' A' ' 37' ' ' ARG . 81.4 t80 -129.6 100.93 5.7 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.738 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.451 HG21 ' N ' ' A' ' 34' ' ' GLY . 90.3 m -96.6 -79.65 0.45 Allowed 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.405 ' HA3' ' HD3' ' A' ' 11' ' ' PRO . . . 128.57 131.79 3.46 Favored Glycine 0 C--N 1.338 0.652 0 CA-C-O 118.83 -0.983 . . . . 0.0 110.666 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.405 ' HD3' ' HA3' ' A' ' 10' ' ' GLY . 15.1 Cg_exo -68.89 72.3 1.05 Allowed 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.704 2.27 . . . . 0.0 112.608 -179.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 51.2 m -126.02 -107.66 0.32 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.042 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -132.0 73.25 1.52 Allowed 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.444 0.64 . . . . 0.0 109.986 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.51 ' HB1' HG13 ' A' ' 32' ' ' VAL . . . -97.75 116.59 30.27 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.638 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -139.3 33.31 2.09 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.836 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 43.1 mt -138.46 121.35 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.362 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.623 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.1 mp -95.47 144.6 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.824 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 57.4 mtt180 -143.86 -174.74 4.34 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.492 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.587 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.1 m-85 -114.63 146.14 41.18 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.985 0.422 . . . . 0.0 112.051 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.599 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 4.0 p90 -139.76 153.96 47.28 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.023 -0.99 . . . . 0.0 108.731 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.525 ' HH ' ' HA3' ' A' ' 26' ' ' GLY . 63.0 t80 -98.74 135.18 40.59 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -101.09 139.65 36.47 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 176.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -96.19 2.87 53.4 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.811 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.6 tttm -99.1 -38.1 9.07 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.52 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -104.53 -25.46 12.76 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.879 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.525 ' HA3' ' HH ' ' A' ' 21' ' ' TYR . . . 67.02 53.18 28.01 Favored Glycine 0 C--N 1.348 1.244 0 C-N-CA 121.341 -0.457 . . . . 0.0 112.637 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.52 ' HG ' ' HB1' ' A' ' 25' ' ' ALA . 3.3 pp -153.17 164.71 37.57 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 122.688 0.395 . . . . 0.0 111.012 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 92.3 m -99.51 109.2 21.76 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.15 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.587 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -97.64 157.64 15.93 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.708 -178.852 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.509 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 34.6 p -87.78 130.09 34.97 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.517 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.599 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 7.5 p90 -152.36 152.64 32.32 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.214 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.623 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.1 t -77.44 161.38 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 C-N-CA 123.628 0.771 . . . . 0.0 112.545 -177.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' A' ' 16' ' ' ILE . 12.3 t80 -132.1 143.1 49.77 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.571 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.451 ' N ' HG21 ' A' ' 9' ' ' THR . . . -100.09 -161.1 28.47 Favored Glycine 0 C--N 1.337 0.597 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.113 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -144.06 3.26 1.47 Allowed Glycine 0 C--N 1.341 0.818 0 C-N-CA 121.139 -0.553 . . . . 0.0 114.094 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 25.7 p -84.24 -53.5 5.45 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.461 0.63 . . . . 0.0 110.534 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.652 ' HD3' ' HE2' ' A' ' 8' ' ' TYR . 54.7 ttt-85 -102.54 -84.54 0.45 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 177.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.428 ' HB3' ' CZ ' ' A' ' 33' ' ' TYR . . . 81.91 126.18 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.347 1.059 . . . . 0.0 112.173 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -112.36 -178.12 3.33 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.616 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 88.4 mtm180 -91.92 6.47 46.09 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.474 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.63 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.2 OUTLIER -96.5 76.51 2.9 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.032 0.444 . . . . 0.0 110.769 179.857 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.824 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 7.7 m120 -156.94 134.23 10.54 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.199 178.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.57 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 32.4 m-85 -134.24 105.5 6.67 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.293 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -73.27 -4.61 34.2 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.9 m -131.15 135.05 47.12 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 120.753 0.311 . . . . 0.0 111.512 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.52 -43.52 84.99 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.411 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -50.91 -56.19 13.54 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 123.667 0.605 . . . . 0.0 111.279 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -64.91 -48.93 72.39 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 116.682 -0.236 . . . . 0.0 110.443 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.568 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 43.1 t -48.02 -47.15 33.64 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 123.729 0.643 . . . . 0.0 111.336 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.19 -42.74 71.97 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.311 0.244 . . . . 0.0 111.405 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -69.5 -15.05 63.18 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.6 m -107.38 -51.88 2.85 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 122.952 0.158 . . . . 0.0 111.297 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.568 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.8 OUTLIER -111.11 18.33 19.5 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -178.967 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.798 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.478 178.681 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.511 0.196 . . . . 0.0 111.158 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.538 ' CD2' ' HB3' ' A' ' 40' ' ' ARG . 3.7 p90 -111.18 149.27 31.17 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.125 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.5 t 175.35 -39.52 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.255 0.622 . . . . 0.0 110.864 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.456 ' HG ' ' CB ' ' A' ' 23' ' ' ALA . 6.1 mp -87.43 17.78 4.28 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 123.402 0.439 . . . . 0.0 111.862 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.441 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 5.8 mm-40 -96.16 122.52 57.81 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.077 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 2.8 Cg_exo -76.71 165.62 28.45 Favored 'Trans proline' 0 C--N 1.368 1.577 0 C-N-CA 123.062 2.508 . . . . 0.0 112.558 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.535 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 28.3 Cg_endo -55.08 135.63 69.63 Favored 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 123.372 2.715 . . . . 0.0 113.386 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.465 ' C ' ' H ' ' A' ' 10' ' ' GLY . 2.7 t80 -95.95 28.67 3.03 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.972 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.661 HG22 HG13 ' A' ' 32' ' ' VAL . 14.1 m -49.65 -4.86 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.465 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . -27.09 131.35 0.04 OUTLIER Glycine 0 N--CA 1.477 1.399 0 CA-C-O 118.219 -1.323 . . . . 0.0 112.42 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -16.91 77.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.076 1 C-N-CA 125.664 4.243 . . . . 0.0 116.013 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.6 m -134.09 176.52 8.51 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.358 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -87.27 55.44 3.54 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.891 0.853 . . . . 0.0 109.941 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.923 ' HB1' HG23 ' A' ' 32' ' ' VAL . . . -80.95 113.44 19.16 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.857 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.681 ' O ' HG13 ' A' ' 16' ' ' ILE . 5.8 tpm_? -133.71 33.33 3.49 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.723 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.681 HG13 ' O ' ' A' ' 15' ' ' ARG . 31.4 mt -154.94 113.83 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.43 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 1.089 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.8 mp -91.42 115.63 30.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 122.312 1.053 . . . . 0.0 109.902 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.734 ' N ' ' O ' ' A' ' 31' ' ' PHE . 2.2 mmp_? -100.8 -156.12 0.54 Allowed 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 112.428 -2.169 . . . . 0.0 110.081 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.499 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 4.8 m-85 -123.75 166.7 15.11 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.84 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 8.4 p90 -162.91 170.96 17.34 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.168 176.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.626 ' HB2' ' SG ' ' A' ' 49' ' ' CYS . 0.8 OUTLIER -115.74 107.91 15.67 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.479 0.312 . . . . 0.0 111.408 -178.852 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.548 ' C ' ' H ' ' A' ' 24' ' ' LYS . 65.5 m-80 -76.49 97.55 4.36 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-O 121.451 0.643 . . . . 0.0 112.064 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.456 ' CB ' ' HG ' ' A' ' 4' ' ' LEU . . . -76.62 24.07 0.15 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.881 177.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.548 ' H ' ' C ' ' A' ' 22' ' ' ASN . 12.7 tmtt? -98.73 -39.95 8.39 Favored 'General case' 0 C--N 1.35 0.624 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 177.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 -51.75 2.84 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.422 -1.263 . . . . 0.0 109.988 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.2 -35.18 1.59 Allowed Glycine 0 C--N 1.348 1.247 0 C-N-CA 121.246 -0.502 . . . . 0.0 112.972 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 pp -87.68 169.28 12.26 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 94.7 m -98.84 139.91 33.81 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.386 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.526 ' HB2' ' ND2' ' A' ' 22' ' ' ASN . 67.7 mt-30 -132.73 158.76 41.57 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 123.466 0.479 . . . . 0.0 110.98 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.499 ' HA ' ' HA ' ' A' ' 19' ' ' TYR . 45.1 p -85.65 121.44 28.33 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.734 ' O ' ' N ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -113.54 178.81 4.15 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 176.682 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 1.089 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.3 p -91.4 -159.16 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 118.794 0.724 . . . . 0.0 110.897 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.467 ' H ' ' CG2' ' A' ' 32' ' ' VAL . 77.2 t80 -173.49 111.34 0.19 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.514 1.125 . . . . 0.0 108.564 177.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.641 ' HA3' ' HA ' ' A' ' 14' ' ' ALA . . . -92.59 163.26 27.2 Favored Glycine 0 C--N 1.336 0.571 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.743 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.31 26.42 11.83 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 121.372 -0.442 . . . . 0.0 113.133 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -95.59 -51.02 4.71 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 122.185 0.194 . . . . 0.0 111.072 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 -145.18 139.8 27.49 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.317 0.385 . . . . 0.0 111.441 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -99.69 118.63 36.61 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.769 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.76 -171.46 2.06 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.236 0.541 . . . . 0.0 111.078 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.538 ' HB3' ' CD2' ' A' ' 2' ' ' PHE . 40.1 mmt180 -82.38 -74.5 0.34 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.428 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.459 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.3 OUTLIER -51.71 101.94 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -148.67 136.19 20.46 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 114.022 -1.445 . . . . 0.0 109.311 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.84 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 59.4 m-85 -138.17 150.07 46.44 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.565 ' HG3' ' NH1' ' A' ' 18' ' ' ARG . 0.7 OUTLIER -97.23 -46.02 6.29 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 114.684 -1.144 . . . . 0.0 111.922 -179.594 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.492 ' HB2' ' OD2' ' A' ' 48' ' ' ASP . 52.9 m -133.3 168.09 19.21 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.199 0.312 . . . . 0.0 111.603 -179.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.424 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -63.25 -64.69 0.83 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.875 0.47 . . . . 0.0 111.814 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.479 ' O ' ' HD2' ' A' ' 51' ' ' ARG . 97.9 mt-10 -53.17 -34.75 58.23 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.809 0.444 . . . . 0.0 111.836 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.492 ' OD2' ' HB2' ' A' ' 45' ' ' SER . 54.8 m-20 -73.52 -33.32 64.7 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.269 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.653 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 33.9 t -63.84 -47.55 80.32 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.914 178.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 74.7 mtm -69.6 -48.22 60.87 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.478 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.479 ' HD2' ' O ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -64.17 -30.41 71.47 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.0 m -90.69 -32.0 16.36 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.55 ' HB3' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -80.85 -51.95 8.03 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 117.856 0.298 . . . . 0.0 111.008 -179.782 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 0.983 0 C-N-CA 121.358 -0.449 . . . . 0.0 112.61 -179.707 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.598 0.237 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -138.52 -32.22 0.71 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.397 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.9 t -77.25 -20.3 55.37 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.855 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.0 pp -88.05 23.78 2.0 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 120.952 0.406 . . . . 0.0 111.874 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -96.01 155.31 38.42 Favored Pre-proline 0 CA--C 1.537 0.447 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.784 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.3 141.45 81.94 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.675 2.25 . . . . 0.0 113.452 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.493 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 29.1 Cg_endo -54.81 133.87 59.86 Favored 'Trans proline' 0 C--N 1.372 1.766 0 C-N-CA 123.968 3.112 . . . . 0.0 114.029 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.438 ' HH ' ' HE ' ' A' ' 37' ' ' ARG . 84.8 t80 -135.54 103.53 5.49 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.592 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.584 HG21 ' HA ' ' A' ' 33' ' ' TYR . 28.5 m -96.49 -78.06 0.47 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.26 146.81 9.38 Favored Glycine 0 C--N 1.342 0.898 0 CA-C-O 119.117 -0.824 . . . . 0.0 111.636 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.469 ' HD2' HH22 ' A' ' 37' ' ' ARG . 7.9 Cg_exo -72.35 68.9 3.4 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.882 2.388 . . . . 0.0 112.247 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.9 m -124.9 -152.8 0.53 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.827 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -87.25 57.65 4.58 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.834 0.826 . . . . 0.0 110.182 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.628 ' HA ' ' HA3' ' A' ' 34' ' ' GLY . . . -85.26 116.17 23.45 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.697 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.498 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 3.4 ppt_? -142.16 21.77 2.08 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.046 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.5 mt -131.96 116.05 29.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.223 -178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.865 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.7 mp -92.83 106.68 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 122.267 1.032 . . . . 0.0 109.355 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.617 ' N ' ' O ' ' A' ' 31' ' ' PHE . 51.2 mtt180 -98.2 174.58 6.44 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 112.825 -1.989 . . . . 0.0 110.955 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.525 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 1.5 m-85 -110.73 152.11 26.96 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.625 0.25 . . . . 0.0 111.093 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.573 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 2.4 p90 -139.83 157.46 45.68 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.579 ' CZ ' ' HA3' ' A' ' 26' ' ' GLY . 80.9 t80 -90.71 129.83 36.76 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.734 0.302 . . . . 0.0 111.366 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.61 ' HB2' HD12 ' A' ' 27' ' ' LEU . 3.2 m120 -96.58 127.66 42.77 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.31 11.79 20.24 Favored 'General case' 0 C--O 1.239 0.526 0 O-C-N 123.416 0.447 . . . . 0.0 111.981 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.703 ' HZ1' ' HB3' ' A' ' 24' ' ' LYS . 9.0 mtpm? -97.42 -25.04 15.34 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.651 0.262 . . . . 0.0 110.916 179.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.403 ' CB ' HD11 ' A' ' 27' ' ' LEU . . . -138.38 -27.37 0.87 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.731 -178.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.579 ' HA3' ' CZ ' ' A' ' 21' ' ' TYR . . . 99.09 8.66 53.45 Favored Glycine 0 C--N 1.344 1.009 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.944 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.61 HD12 ' HB2' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -96.51 151.21 19.79 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.581 0.229 . . . . 0.0 111.344 -179.634 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 87.3 m -93.56 110.26 21.85 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.36 178.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.573 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 33.1 tt0 -88.0 159.14 18.42 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.048 -177.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.435 HG23 ' CE1' ' A' ' 19' ' ' TYR . 35.5 p -96.32 128.69 43.48 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.442 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.617 ' O ' ' N ' ' A' ' 18' ' ' ARG . 7.7 p90 -152.2 152.22 31.97 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.643 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.865 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -78.33 174.28 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 C-N-CA 123.491 0.717 . . . . 0.0 111.982 -177.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.584 ' HA ' HG21 ' A' ' 9' ' ' THR . 48.0 t80 -155.99 139.5 15.89 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.352 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.628 ' HA3' ' HA ' ' A' ' 14' ' ' ALA . . . -102.59 -55.0 0.85 Allowed Glycine 0 C--N 1.338 0.685 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.187 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 98.36 27.37 8.7 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.527 -0.368 . . . . 0.0 113.319 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.6 p -95.79 -43.07 8.03 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.28 0.232 . . . . 0.0 111.545 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.469 HH22 ' HD2' ' A' ' 11' ' ' PRO . 84.4 mtm-85 -116.03 8.87 14.68 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 123.357 0.411 . . . . 0.0 111.644 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 12.2 118.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -92.7 -124.69 0.09 Allowed 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.721 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -140.46 -34.74 0.52 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 118.35 0.523 . . . . 0.0 111.47 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.449 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.4 OUTLIER -83.81 96.92 8.91 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.004 0.43 . . . . 0.0 111.789 -179.062 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.571 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 8.7 m120 -154.92 118.48 4.53 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.271 177.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.525 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 28.8 m-85 -137.96 105.69 5.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.726 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -76.36 2.45 13.45 Favored 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.5 m -135.77 132.12 36.37 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.222 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.69 -45.48 89.84 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.392 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -48.39 -55.25 11.28 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.426 0.69 . . . . 0.0 111.516 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -66.15 -45.63 80.32 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 122.449 0.3 . . . . 0.0 110.749 178.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.425 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 44.7 t -47.06 -50.38 19.75 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 123.803 0.689 . . . . 0.0 111.393 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 94.9 mtp -77.38 -35.72 54.14 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.638 0.375 . . . . 0.0 111.973 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -62.47 -28.69 69.99 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 9.8 m -104.09 -52.19 2.99 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 123.196 0.31 . . . . 0.0 110.944 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.425 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -99.45 19.71 15.12 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.31 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.874 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.433 178.661 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . 0.931 ' H1 ' HH22 ' A' ' 40' ' ' ARG . 47.1 t0 . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.521 0.2 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.418 ' HD1' ' SG ' ' A' ' 3' ' ' CYS . 12.3 p90 -130.94 -171.19 2.51 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.936 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.464 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 67.8 m 72.54 -51.56 0.7 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.379 1.071 . . . . 0.0 112.698 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 57.6 mt -79.35 -11.96 59.93 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -95.04 146.49 31.41 Favored Pre-proline 0 CA--C 1.535 0.398 0 O-C-N 123.18 0.3 . . . . 0.0 110.388 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.17 163.0 30.59 Favored 'Trans proline' 0 C--N 1.369 1.631 0 C-N-CA 122.804 2.336 . . . . 0.0 112.725 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.52 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 55.4 Cg_endo -62.44 153.11 73.13 Favored 'Trans proline' 0 C--N 1.373 1.823 0 C-N-CA 123.009 2.473 . . . . 0.0 112.448 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.717 ' HE2' ' HD3' ' A' ' 37' ' ' ARG . 2.0 t80 -88.31 22.15 2.59 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.787 HG22 HG13 ' A' ' 32' ' ' VAL . 7.1 m -55.6 -5.86 0.16 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.94 0.496 . . . . 0.0 111.789 178.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.46 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . -28.7 -90.52 0.01 OUTLIER Glycine 0 C--N 1.352 1.472 0 C-N-CA 124.253 0.93 . . . . 0.0 114.446 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -89.58 14.37 2.18 Favored 'Trans proline' 0 C--N 1.362 1.273 0 C-N-CA 122.933 2.422 . . . . 0.0 113.38 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.443 ' O ' HG21 ' A' ' 9' ' ' THR . 3.1 m -137.97 122.49 18.46 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 120.603 0.24 . . . . 0.0 110.883 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.548 ' HG3' HG21 ' A' ' 9' ' ' THR . 0.3 OUTLIER -141.53 82.66 1.83 Allowed 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.865 179.725 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.86 -170.83 2.68 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.175 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.65 38.09 1.88 Allowed 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.041 0.448 . . . . 0.0 112.133 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.548 ' O ' HG21 ' A' ' 32' ' ' VAL . 20.5 mt -129.96 102.02 6.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.482 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.911 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 44.9 mm -91.26 144.29 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.772 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.8 ' N ' ' O ' ' A' ' 31' ' ' PHE . 4.0 ttt180 -134.8 -154.78 0.61 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.657 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.494 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 10.6 m-85 -120.33 156.36 31.47 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.292 0.496 . . . . 0.0 111.73 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.583 ' HD1' ' O ' ' A' ' 29' ' ' GLN . 0.1 OUTLIER -164.75 179.91 6.27 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 114.838 -1.073 . . . . 0.0 112.131 177.716 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.435 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 63.6 t80 -94.76 168.74 10.63 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -142.95 123.54 14.05 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 120.056 1.298 . . . . 0.0 109.953 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.63 12.99 6.13 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.603 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.666 ' HB2' ' HZ1' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -98.35 -39.04 9.0 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-O 121.035 0.445 . . . . 0.0 110.477 178.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.875 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -112.06 -35.65 5.6 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.388 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.06 -39.4 2.68 Favored Glycine 0 C--N 1.341 0.85 0 O-C-N 123.48 0.488 . . . . 0.0 112.615 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.875 HD22 ' HB2' ' A' ' 25' ' ' ALA . 1.2 pt? -82.59 -163.83 0.76 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 98.3 m -111.0 144.91 39.36 Favored 'General case' 0 C--N 1.347 0.469 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.357 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.583 ' O ' ' HD1' ' A' ' 20' ' ' PHE . 3.2 tp-100 -144.44 169.24 18.31 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.611 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.8 p -87.09 126.94 35.09 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -178.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.8 ' O ' ' N ' ' A' ' 18' ' ' ARG . 1.8 p90 -122.64 170.93 9.53 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.247 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.911 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.5 p -76.14 -161.74 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 C-N-CA 123.449 0.699 . . . . 0.0 111.35 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.455 ' H ' ' CG2' ' A' ' 32' ' ' VAL . 71.2 t80 179.39 117.78 0.05 OUTLIER 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.681 1.192 . . . . 0.0 108.947 178.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -115.53 148.51 18.91 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.34 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -86.13 46.97 3.69 Favored Glycine 0 C--N 1.34 0.755 0 C-N-CA 121.499 -0.381 . . . . 0.0 112.33 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.7 p -95.19 -46.25 6.85 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.873 0.396 . . . . 0.0 111.34 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.717 ' HD3' ' HE2' ' A' ' 8' ' ' TYR . 53.9 ttt-85 -137.9 -36.97 0.6 Allowed 'General case' 0 CA--C 1.536 0.424 0 O-C-N 123.372 0.42 . . . . 0.0 111.216 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 63.47 116.03 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.59 0.756 . . . . 0.0 111.725 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.5 mmtt -105.46 -163.67 0.96 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.423 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.931 HH22 ' H1 ' ' A' ' 1' ' ' ASP . 89.1 mtm180 -82.38 -76.08 0.28 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.46 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.443 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.4 OUTLIER -39.65 99.2 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -177.817 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -148.8 129.02 13.69 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 114.254 -1.339 . . . . 0.0 110.155 177.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 84.4 m-85 -134.19 148.02 50.84 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -98.47 -41.31 7.84 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.671 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.4 m -132.32 163.56 28.38 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.75 -55.51 29.41 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.194 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.47 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 60.4 mp0 -52.18 -28.63 18.96 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -80.38 -39.1 29.07 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 43' ' ' PHE . 36.3 t -67.01 -24.06 65.98 Favored 'General case' 0 C--N 1.35 0.622 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.661 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.462 ' O ' ' N ' ' A' ' 54' ' ' GLY . 94.8 mtp -81.29 -55.99 4.36 Favored 'General case' 0 C--N 1.348 0.541 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.47 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 99.3 mtt180 -45.66 -37.4 5.69 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.823 0.449 . . . . 0.0 111.483 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.8 m -90.28 -58.53 2.47 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 123.483 0.489 . . . . 0.0 110.044 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.464 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -121.34 62.46 0.9 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.462 ' N ' ' O ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.336 0.537 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.574 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.556 0.217 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.437 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 3.0 p90 -118.66 -158.96 0.74 Allowed 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.115 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.439 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 56.0 m 73.03 -51.26 0.71 Allowed 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.346 1.058 . . . . 0.0 111.891 -179.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.62 HD11 ' HB3' ' A' ' 23' ' ' ALA . 4.4 mm? -80.11 -2.2 43.47 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.727 0.411 . . . . 0.0 111.892 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -94.1 155.21 40.31 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.721 179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -67.02 148.56 81.86 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.826 2.351 . . . . 0.0 112.945 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.523 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 38.3 Cg_endo -58.97 138.62 86.69 Favored 'Trans proline' 0 C--N 1.371 1.739 0 C-N-CA 123.624 2.882 . . . . 0.0 113.884 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.535 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 32.0 t80 -128.78 95.51 4.12 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.238 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.2 m -95.22 -70.8 0.7 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.563 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.2 160.23 23.39 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-O 119.288 -0.729 . . . . 0.0 112.141 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.533 ' HA ' ' HZ1' ' A' ' 13' ' ' LYS . 3.0 Cg_exo -74.99 64.21 6.03 Favored 'Trans proline' 0 C--N 1.369 1.644 0 C-N-CA 122.937 2.424 . . . . 0.0 112.753 -179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.6 m -132.0 -65.25 0.75 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.756 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.533 ' HZ1' ' HA ' ' A' ' 11' ' ' PRO . 11.5 mptt 53.07 87.1 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.078 0.951 . . . . 0.0 112.342 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.514 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -87.28 48.92 1.72 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.255 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.2 OUTLIER 43.05 36.55 0.95 Allowed 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 178.87 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.476 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 38.1 mt -132.35 141.64 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.966 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.788 HG13 HG21 ' A' ' 32' ' ' VAL . 5.0 mp -117.85 103.33 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 122.159 0.981 . . . . 0.0 108.513 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.607 ' N ' ' O ' ' A' ' 31' ' ' PHE . 19.2 mtt180 -90.77 -169.04 2.24 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 113.106 -1.861 . . . . 0.0 111.404 -179.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.417 ' CE2' ' HB3' ' A' ' 46' ' ' ALA . 10.6 m-85 -124.84 158.96 32.16 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 122.334 0.254 . . . . 0.0 110.898 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.544 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 7.6 p90 -157.48 169.13 25.41 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 177.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.727 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 64.6 t80 -94.74 116.51 28.83 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.797 0.332 . . . . 0.0 110.955 179.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.568 HD22 ' HB2' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -98.69 83.68 3.01 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.542 179.443 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.62 ' HB3' HD11 ' A' ' 4' ' ' LEU . . . -55.68 -3.31 0.07 Allowed 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -179.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.451 ' H ' ' C ' ' A' ' 22' ' ' ASN . 79.9 tttt -96.48 -29.73 13.74 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.455 ' HB1' ' HB2' ' A' ' 22' ' ' ASN . . . -89.96 -33.4 16.4 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.85 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.21 -15.9 15.4 Favored Glycine 0 C--N 1.344 0.984 0 C-N-CA 121.055 -0.593 . . . . 0.0 114.274 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 pp -154.26 -169.71 3.32 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 117.436 0.618 . . . . 0.0 111.737 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.544 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 58.8 m -81.7 139.82 34.68 Favored 'General case' 0 C--N 1.35 0.614 0 C-N-CA 122.867 0.467 . . . . 0.0 111.088 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.568 ' HB2' HD22 ' A' ' 22' ' ' ASN . 70.1 mt-30 -131.45 157.74 42.68 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.47 0.652 . . . . 0.0 112.653 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -77.81 130.14 36.32 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 113.382 -1.735 . . . . 0.0 111.766 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.607 ' O ' ' N ' ' A' ' 18' ' ' ARG . 5.9 p90 -150.93 151.59 32.37 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.299 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.788 HG21 HG13 ' A' ' 17' ' ' ILE . 20.7 t -76.59 125.19 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.833 0.853 . . . . 0.0 110.922 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.548 ' CG ' ' HD2' ' A' ' 18' ' ' ARG . 51.8 t80 -103.32 155.27 18.59 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.995 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.449 ' HA3' ' H ' ' A' ' 14' ' ' ALA . . . -105.8 -58.62 0.63 Allowed Glycine 0 C--N 1.336 0.566 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.496 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 87.33 17.95 58.05 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 121.473 -0.394 . . . . 0.0 113.004 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 25.5 p -95.05 -38.39 10.66 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 122.565 0.346 . . . . 0.0 111.245 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.471 ' HD3' ' HH ' ' A' ' 8' ' ' TYR . 59.9 ttt180 -126.92 29.68 5.6 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 123.411 0.444 . . . . 0.0 110.581 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.508 ' HB3' ' OH ' ' A' ' 33' ' ' TYR . . . -18.61 130.66 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -179.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.535 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 17.3 tptm -108.32 -132.57 0.32 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.424 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -123.35 -54.61 1.78 Allowed 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.584 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.2 OUTLIER -66.54 80.22 0.1 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.247 0.546 . . . . 0.0 111.372 -179.47 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.468 ' ND2' ' HZ ' ' A' ' 31' ' ' PHE . 10.2 m120 -157.69 142.88 16.9 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.238 178.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -133.41 154.18 50.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.963 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -97.65 -46.94 5.81 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.04 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.7 t -112.95 150.48 31.79 Favored 'General case' 0 C--O 1.241 0.625 0 O-C-N 123.486 0.492 . . . . 0.0 111.509 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.417 ' HB3' ' CE2' ' A' ' 19' ' ' TYR . . . -68.04 -38.19 82.21 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.819 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.415 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 67.4 tt0 -57.25 -42.94 82.48 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 123.499 0.499 . . . . 0.0 110.998 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -70.6 -54.74 10.85 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.203 178.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 14.1 t -54.64 -29.69 53.05 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.463 0.477 . . . . 0.0 111.992 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.519 ' HA ' ' HA2' ' A' ' 54' ' ' GLY . 53.0 mtt -77.9 -47.96 17.48 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 122.819 0.448 . . . . 0.0 111.105 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 99.4 mtt180 -59.82 -30.88 69.23 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.398 0.436 . . . . 0.0 111.675 179.198 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.7 m -89.24 -55.81 3.52 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.727 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 2.7 p -138.98 68.58 1.38 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.015 0.436 . . . . 0.0 111.593 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.519 ' HA2' ' HA ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.339 0.727 0 C-N-CA 121.086 -0.578 . . . . 0.0 112.466 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 120.519 0.199 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.836 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 6.5 p90 -95.78 5.87 50.28 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.977 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.6 t -86.16 -11.26 53.04 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.797 0.439 . . . . 0.0 111.289 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.557 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 50.9 mt -125.08 -4.01 7.5 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.821 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -93.77 146.92 32.63 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.464 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -78.76 162.81 26.75 Favored 'Trans proline' 0 C--N 1.371 1.739 0 C-N-CA 123.327 2.685 . . . . 0.0 112.915 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.633 ' HD3' ' HE2' ' A' ' 20' ' ' PHE . 66.8 Cg_endo -66.35 159.75 48.68 Favored 'Trans proline' 0 C--N 1.374 1.895 0 C-N-CA 123.202 2.601 . . . . 0.0 113.727 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.472 ' HB3' ' HG2' ' A' ' 39' ' ' LYS . 54.0 t80 -137.17 83.85 2.02 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.573 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.6 m -95.86 -55.88 2.85 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.232 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.89 -159.07 29.97 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 119.303 -0.721 . . . . 0.0 112.731 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -75.48 -1.1 10.9 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 123.017 2.478 . . . . 0.0 113.058 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.13 142.9 26.99 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.634 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -140.32 89.85 2.32 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.7 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.402 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -78.03 176.1 9.48 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.824 -179.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.491 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 0.1 OUTLIER -105.1 25.98 9.88 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.16 0.505 . . . . 0.0 111.823 -179.045 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.485 ' C ' HG11 ' A' ' 32' ' ' VAL . 12.2 mt -127.66 86.76 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.571 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.99 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.6 mp -82.74 145.0 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.423 0.63 . . . . 0.0 109.798 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.508 ' N ' ' O ' ' A' ' 31' ' ' PHE . 5.8 ttm-85 -139.6 -161.46 1.19 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.22 -1.355 . . . . 0.0 110.395 -177.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -119.24 165.6 14.03 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 120.626 0.25 . . . . 0.0 111.52 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.633 ' HE2' ' HD3' ' A' ' 7' ' ' PRO . 1.6 p90 -166.08 -178.27 4.57 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.397 176.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.533 ' HE2' ' SD ' ' A' ' 50' ' ' MET . 34.7 t80 -125.27 130.12 51.41 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -106.52 125.46 51.03 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 120.621 0.248 . . . . 0.0 110.983 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . 0.557 ' HB3' ' HA ' ' A' ' 4' ' ' LEU . . . -82.42 15.27 2.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.208 178.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.3 tptp -97.18 -39.92 9.05 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.503 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.532 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -102.62 -32.46 9.88 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.999 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 97.18 9.58 55.51 Favored Glycine 0 C--N 1.34 0.797 0 CA-C-N 115.904 -0.589 . . . . 0.0 114.088 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.862 ' HG ' HE22 ' A' ' 29' ' ' GLN . 0.6 OUTLIER -132.93 173.89 10.92 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 117.292 0.546 . . . . 0.0 111.479 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.504 ' SG ' ' HD2' ' A' ' 21' ' ' TYR . 72.8 m -90.2 133.64 34.78 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.775 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.862 HE22 ' HG ' ' A' ' 27' ' ' LEU . 12.6 mp0 -112.92 -162.36 0.8 Allowed 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.706 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 41.3 p -131.26 126.75 36.25 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.242 0.617 . . . . 0.0 109.741 178.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.533 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 2.5 p90 -145.19 149.18 34.49 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.586 -178.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.99 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -73.89 179.9 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 124.462 1.105 . . . . 0.0 112.251 -176.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.592 ' OH ' ' HB3' ' A' ' 38' ' ' ALA . 50.8 t80 -158.54 135.24 9.57 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.784 0.834 . . . . 0.0 109.334 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.3 -174.27 14.18 Favored Glycine 0 C--N 1.336 0.529 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.838 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -89.56 8.51 79.68 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 121.535 -0.364 . . . . 0.0 113.029 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.11 -52.07 4.37 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 122.724 0.409 . . . . 0.0 111.88 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -132.24 110.48 10.65 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.05 0.452 . . . . 0.0 111.321 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.592 ' HB3' ' OH ' ' A' ' 33' ' ' TYR . . . -101.08 140.92 34.71 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.801 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.472 ' HG2' ' HB3' ' A' ' 8' ' ' TYR . 6.9 mmtt -115.02 -162.18 0.81 Allowed 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.46 0.475 . . . . 0.0 110.777 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.2 mmt180 -125.16 3.54 7.89 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.863 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.836 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -119.55 100.39 7.25 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.03 0.443 . . . . 0.0 110.162 179.104 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -134.68 132.2 38.62 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.824 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.491 ' CD1' ' HA ' ' A' ' 49' ' ' CYS . 55.0 m-85 -142.53 164.72 29.36 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.004 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -99.54 -44.84 6.01 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.166 0.186 . . . . 0.0 110.89 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -136.4 161.41 35.89 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.652 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.72 -25.72 67.61 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.647 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -59.72 -70.6 0.16 Allowed 'General case' 0 N--CA 1.474 0.742 0 O-C-N 123.413 0.445 . . . . 0.0 109.849 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -58.98 -40.16 84.0 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 122.88 0.472 . . . . 0.0 110.46 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.491 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 49.7 t -52.58 -58.16 7.69 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.758 0.661 . . . . 0.0 111.559 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.831 ' HE3' ' HA ' ' A' ' 27' ' ' LEU . 5.5 mmt -64.54 -42.24 95.85 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.7 tpp85 -70.25 -24.95 63.16 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.2 m -90.46 -40.63 11.91 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 122.995 0.185 . . . . 0.0 111.392 -179.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.9 -55.09 4.0 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.902 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.625 -179.954 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.497 0.189 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.536 ' HD1' ' H ' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -130.84 -20.08 2.86 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.848 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 18.7 m -71.21 -42.76 68.56 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 122.832 0.453 . . . . 0.0 112.14 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.3 mp -79.86 -7.89 58.98 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.172 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -92.74 153.32 42.24 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.939 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -64.08 139.66 68.09 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 122.705 2.27 . . . . 0.0 113.282 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.632 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 37.6 Cg_endo -58.43 136.46 74.46 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 123.555 2.836 . . . . 0.0 114.197 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -99.45 89.12 4.07 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.217 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.5 m -96.43 -63.37 1.15 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.458 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.571 ' HA2' ' HD2' ' A' ' 37' ' ' ARG . . . 84.76 -174.93 50.29 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 119.251 -0.749 . . . . 0.0 112.338 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.509 ' HD2' ' HE ' ' A' ' 37' ' ' ARG . 3.4 Cg_exo -76.95 17.88 0.8 Allowed 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.946 2.431 . . . . 0.0 113.141 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.74 132.48 56.15 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.651 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.424 ' CB ' HG13 ' A' ' 32' ' ' VAL . 10.1 mptt -139.02 86.21 2.12 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.243 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.487 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -80.32 52.99 1.69 Allowed 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.973 -1.012 . . . . 0.0 112.456 -179.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.4 OUTLIER 42.13 36.2 0.67 Allowed 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 178.903 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.607 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 37.6 mt -136.46 121.6 26.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-N 116.264 -0.426 . . . . 0.0 109.86 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.541 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.4 mp -121.91 106.36 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 122.177 0.989 . . . . 0.0 108.799 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.64 ' N ' ' O ' ' A' ' 31' ' ' PHE . 33.0 mtp180 -81.88 -160.07 0.33 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 113.227 -1.806 . . . . 0.0 111.178 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 15.7 m-85 -129.81 113.5 14.77 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.563 ' HB3' ' CD1' ' A' ' 31' ' ' PHE . 4.8 p90 -106.87 -174.59 2.57 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.644 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -128.42 134.72 48.85 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.326 0.107 . . . . 0.0 110.924 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -106.57 107.4 18.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.29 -2.73 6.43 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -96.38 -34.4 11.56 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.598 0.237 . . . . 0.0 110.588 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -92.18 -41.76 10.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.0 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.08 52.04 2.66 Favored Glycine 0 C--N 1.342 0.865 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 pp -166.35 162.14 16.96 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 123.108 0.563 . . . . 0.0 111.159 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 m -94.91 111.49 23.28 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.746 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.544 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 16.8 tp60 -87.73 -163.74 0.99 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.461 -179.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.536 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 33.6 p -129.4 133.37 47.33 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.64 ' O ' ' N ' ' A' ' 18' ' ' ARG . 14.3 p90 -133.97 148.24 51.13 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.893 0.378 . . . . 0.0 111.569 -178.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.607 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 10.9 t -77.06 125.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 123.933 0.893 . . . . 0.0 111.791 -178.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.616 ' HE1' ' H ' ' A' ' 39' ' ' LYS . 77.5 t80 -126.53 129.16 48.08 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.108 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.418 ' HA3' ' HB3' ' A' ' 14' ' ' ALA . . . -128.04 -170.82 12.89 Favored Glycine 0 C--N 1.336 0.547 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.274 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -87.98 -9.64 70.55 Favored Glycine 0 C--N 1.341 0.811 0 O-C-N 123.735 0.314 . . . . 0.0 112.947 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.72 -34.67 27.18 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.789 0.436 . . . . 0.0 112.143 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.571 ' HD2' ' HA2' ' A' ' 10' ' ' GLY . 84.0 mtt-85 -129.58 83.87 2.17 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.504 0.668 . . . . 0.0 110.383 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -93.09 117.63 30.29 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.511 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.616 ' H ' ' HE1' ' A' ' 33' ' ' TYR . 7.4 mmtt -147.06 -174.83 4.6 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.567 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -109.75 90.2 3.24 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.632 ' ND2' ' HA ' ' A' ' 7' ' ' PRO . 0.6 OUTLIER -87.27 -68.63 0.74 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.802 -178.265 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.558 ' CB ' ' HA ' ' A' ' 20' ' ' PHE . 9.1 t-20 -150.75 -94.55 0.06 Allowed 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.489 ' HD2' ' OD1' ' A' ' 42' ' ' ASN . 66.9 m-85 -154.77 168.88 25.39 Favored 'General case' 0 C--N 1.349 0.56 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.631 ' HG2' ' HG2' ' A' ' 18' ' ' ARG . 0.6 OUTLIER -95.66 -24.56 16.5 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.288 178.587 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.471 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 26.1 t -112.53 153.68 27.1 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 120.915 0.388 . . . . 0.0 111.665 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.4 -49.63 46.97 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.442 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.2 tt0 -56.32 -34.72 66.8 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.781 0.433 . . . . 0.0 111.151 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.471 ' OD2' ' HB3' ' A' ' 45' ' ' SER . 51.7 m-20 -72.7 -51.03 20.99 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.495 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.6 t -60.79 -30.81 70.27 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.181 178.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 63.9 mtt -75.74 -49.38 18.4 Favored 'General case' 0 C--N 1.345 0.376 0 C-N-CA 123.022 0.529 . . . . 0.0 111.434 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.448 ' HG2' ' HA ' ' A' ' 48' ' ' ASP . 17.4 ptm180 -61.35 -28.01 68.91 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.8 m -92.5 -61.99 1.49 Allowed 'General case' 0 CA--C 1.549 0.91 0 O-C-N 123.281 0.363 . . . . 0.0 111.681 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.495 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -92.32 -23.71 19.18 Favored 'General case' 0 C--N 1.346 0.429 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -178.426 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.7 0 C-N-CA 120.837 -0.697 . . . . 0.0 113.043 -179.489 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . 0.55 ' OD2' HD13 ' A' ' 4' ' ' LEU . 1.5 m-20 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 120.531 0.205 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.68 -21.26 1.73 Allowed 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -89.29 -13.84 37.14 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.634 HD22 ' HE2' ' A' ' 21' ' ' TYR . 75.2 mt -79.2 -8.5 59.06 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -95.56 153.92 39.37 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -66.34 167.0 19.64 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 123.058 2.506 . . . . 0.0 112.776 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.504 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 55.8 Cg_endo -60.87 126.0 18.56 Favored 'Trans proline' 0 C--N 1.375 1.974 0 C-N-CA 123.151 2.568 . . . . 0.0 112.542 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.519 ' CZ ' ' HD3' ' A' ' 37' ' ' ARG . 6.6 t80 -94.01 7.24 45.84 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 32' ' ' VAL . 7.3 m -55.79 -11.51 1.01 Allowed 'General case' 0 N--CA 1.484 1.244 0 O-C-N 122.272 -0.267 . . . . 0.0 111.615 179.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 53.14 -154.79 6.23 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.581 -0.736 . . . . 0.0 113.177 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -85.06 34.17 0.5 Allowed 'Trans proline' 0 C--N 1.367 1.505 0 C-N-CA 123.004 2.469 . . . . 0.0 112.292 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 34.5 m -87.56 -66.68 0.89 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.785 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 64.9 96.4 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.847 0.859 . . . . 0.0 111.701 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.492 ' HB3' ' H ' ' A' ' 15' ' ' ARG . . . -91.51 -141.1 0.18 Allowed 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.185 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.519 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 2.4 ppt_? -135.21 24.28 3.52 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.163 0.506 . . . . 0.0 111.748 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.502 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 33.0 mt -132.56 102.47 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.29 -179.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.666 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.2 mp -91.12 150.39 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 121.368 0.604 . . . . 0.0 109.596 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.794 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 17.1 mtt180 -145.21 -158.89 0.93 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.666 -178.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.602 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 5.7 m-85 -124.8 115.27 20.42 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.601 ' HB3' ' CD1' ' A' ' 31' ' ' PHE . 9.3 p90 -106.83 -167.65 1.31 Allowed 'General case' 0 CA--C 1.553 1.063 0 O-C-N 123.911 0.757 . . . . 0.0 109.565 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.634 ' HE2' HD22 ' A' ' 4' ' ' LEU . 0.8 OUTLIER -140.44 128.25 21.84 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.979 -0.451 . . . . 0.0 110.964 179.395 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -93.9 116.87 29.35 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 177.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.41 13.49 2.42 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.952 0.406 . . . . 0.0 111.31 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -97.04 -33.2 11.63 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.873 178.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.39 -47.49 3.38 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.157 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.08 -39.95 1.86 Allowed Glycine 0 C--N 1.345 1.043 0 C-N-CA 121.368 -0.444 . . . . 0.0 112.467 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.88 158.56 36.2 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -178.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.527 ' SG ' ' O ' ' A' ' 20' ' ' PHE . 35.9 t -97.49 118.86 34.93 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.047 178.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.472 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -104.78 -162.4 0.88 Allowed 'General case' 0 N--CA 1.466 0.329 0 O-C-N 122.989 0.181 . . . . 0.0 111.267 -177.565 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.588 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 37.3 p -114.38 154.81 27.42 Favored 'General case' 0 C--N 1.344 0.35 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.601 ' CD1' ' HB3' ' A' ' 20' ' ' PHE . 4.7 p90 -160.75 151.39 18.34 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.788 0.328 . . . . 0.0 110.796 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.666 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 5.8 t -87.07 136.49 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.31 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.917 ' HH ' ' HB2' ' A' ' 38' ' ' ALA . 44.0 t80 -102.18 111.27 23.48 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.701 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -100.06 151.55 19.18 Favored Glycine 0 C--N 1.336 0.551 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.661 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -92.29 34.17 4.57 Favored Glycine 0 C--N 1.338 0.663 0 C-N-CA 121.511 -0.375 . . . . 0.0 112.739 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.5 p -95.26 -39.9 9.83 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 122.47 0.308 . . . . 0.0 111.15 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.519 ' HD3' ' CZ ' ' A' ' 8' ' ' TYR . 88.2 mtt-85 -129.51 -50.16 1.17 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.467 0.48 . . . . 0.0 110.81 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.917 ' HB2' ' HH ' ' A' ' 33' ' ' TYR . . . 60.18 136.38 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.111 0.964 . . . . 0.0 113.137 179.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -138.23 -170.77 2.88 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.397 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -104.55 52.07 0.76 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.464 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.525 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.3 OUTLIER -145.44 91.21 2.09 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.053 0.454 . . . . 0.0 110.727 179.125 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.794 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 7.5 m120 -153.68 131.5 11.62 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.117 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.602 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 35.5 m-85 -134.61 132.2 38.74 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.834 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.713 ' HD3' ' HE ' ' A' ' 18' ' ' ARG . 3.6 mmmp? -95.48 -5.1 43.7 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.889 -179.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -137.79 143.25 40.99 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.104 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.24 -53.31 38.49 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.658 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -55.14 -39.16 69.13 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.265 0.626 . . . . 0.0 111.917 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -74.34 -36.65 63.66 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 35.1 t -64.29 -27.74 69.24 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 115.074 -0.967 . . . . 0.0 110.017 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 94.1 mtp -80.55 -48.56 12.55 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.754 178.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.34 -38.65 43.15 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.128 0.571 . . . . 0.0 111.243 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.0 m -99.15 -54.72 2.89 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 123.308 0.38 . . . . 0.0 110.947 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -103.37 39.92 1.5 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -178.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.308 0 CA-C-N 116.202 -0.453 . . . . 0.0 112.5 179.194 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . 0.725 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 54.0 m-20 . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 120.488 0.185 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.538 ' O ' ' HB2' ' A' ' 41' ' ' ASN . 24.8 p90 -123.39 -34.37 3.11 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.7 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.37 -9.25 39.4 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.407 0.442 . . . . 0.0 111.017 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.725 ' HB2' ' HB3' ' A' ' 1' ' ' ASP . 2.8 mm? -83.13 -7.43 59.63 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.298 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -94.15 157.27 37.96 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 122.485 0.314 . . . . 0.0 111.244 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -62.9 171.51 5.92 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 122.943 2.429 . . . . 0.0 112.671 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.533 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 23.2 Cg_endo -53.01 133.88 53.63 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 123.515 2.81 . . . . 0.0 113.298 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.612 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 60.4 t80 -122.55 54.06 1.22 Allowed 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.261 -178.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.466 HG21 ' O ' ' A' ' 12' ' ' CYS . 20.4 m -96.08 12.59 30.08 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 36.71 -143.75 0.14 Allowed Glycine 0 CA--C 1.537 1.407 0 CA-C-N 114.287 -1.324 . . . . 0.0 114.398 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -81.13 1.8 9.04 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 123.111 2.541 . . . . 0.0 113.131 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.466 ' O ' HG21 ' A' ' 9' ' ' THR . 0.1 OUTLIER -98.12 149.11 22.86 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.879 -179.769 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -146.89 96.21 2.71 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.856 0.862 . . . . 0.0 109.381 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.996 ' HB1' ' HA3' ' A' ' 34' ' ' GLY . . . -79.4 33.92 0.25 Allowed 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.897 -1.047 . . . . 0.0 113.163 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.601 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER 44.9 26.83 0.23 Allowed 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 178.408 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 14' ' ' ALA . 28.4 mt -130.22 118.43 43.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.31 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 1.028 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 34.4 mt -81.07 139.24 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-O 121.624 0.726 . . . . 0.0 110.288 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.811 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 3.8 ttt180 -131.93 -170.49 2.41 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.927 -177.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.3 m-85 -126.3 154.06 43.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 122.487 0.315 . . . . 0.0 111.028 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.634 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 10.3 p90 -144.75 158.6 43.72 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.583 ' HE2' HD23 ' A' ' 4' ' ' LEU . 12.3 t80 -90.87 120.34 31.81 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.432 ' C ' ' H ' ' A' ' 24' ' ' LYS . 3.9 m120 -103.48 100.22 10.07 Favored 'General case' 0 C--O 1.244 0.811 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 175.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.03 16.25 0.25 Allowed 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -178.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.432 ' H ' ' C ' ' A' ' 22' ' ' ASN . 79.9 tttt -96.2 -26.16 15.55 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.873 178.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.928 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -116.79 -38.08 3.51 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.317 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 104.82 31.35 4.52 Favored Glycine 0 C--N 1.343 0.919 0 C-N-CA 121.276 -0.488 . . . . 0.0 113.304 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.928 HD22 ' HB1' ' A' ' 25' ' ' ALA . 0.5 OUTLIER -152.42 168.44 25.48 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.896 0.379 . . . . 0.0 111.499 179.509 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.535 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 97.7 m -94.54 127.5 40.52 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.772 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.557 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 52.5 tp60 -94.74 159.13 15.2 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.074 -179.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 37.0 p -94.98 124.53 39.08 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.666 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.713 ' O ' ' N ' ' A' ' 18' ' ' ARG . 3.7 p90 -155.58 160.93 40.87 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.287 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 1.028 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.5 t -72.8 -179.02 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.061 0 C-N-CA 123.294 0.638 . . . . 0.0 111.87 -177.081 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.682 ' HH ' ' HB3' ' A' ' 38' ' ' ALA . 48.7 t80 -148.71 155.76 41.45 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.037 -178.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.996 ' HA3' ' HB1' ' A' ' 14' ' ' ALA . . . -142.95 140.52 9.82 Favored Glycine 0 C--N 1.335 0.526 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.767 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -78.64 2.21 68.94 Favored Glycine 0 C--N 1.341 0.823 0 C-N-CA 121.523 -0.37 . . . . 0.0 113.036 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.56 -2.92 47.45 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -133.55 -13.33 2.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . 0.682 ' HB3' ' HH ' ' A' ' 33' ' ' TYR . . . -8.81 119.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.951 1.3 . . . . 0.0 114.389 -179.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.612 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 21.7 tptm -127.65 -108.88 0.29 Allowed 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.828 -178.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -153.27 -32.35 0.12 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.726 0.81 . . . . 0.0 111.684 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.549 ' ND2' ' HB2' ' A' ' 20' ' ' PHE . 14.2 t30 -67.8 -2.56 7.38 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.033 0.933 . . . . 0.0 113.396 -178.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.811 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 2.2 m120 -105.34 139.37 40.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.868 0.366 . . . . 0.0 110.716 -178.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.434 ' C ' ' HG2' ' A' ' 18' ' ' ARG . 5.5 m-85 -151.96 126.26 9.32 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.154 -178.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.736 ' HD2' ' HE ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -65.06 -39.78 93.75 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -179.774 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -99.67 128.73 45.77 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 120.987 0.422 . . . . 0.0 111.997 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.15 -41.23 99.24 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.993 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 51' ' ' ARG . 20.1 pt-20 -48.14 -55.91 9.14 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.917 0.76 . . . . 0.0 111.6 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -66.67 -45.94 77.29 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 122.457 0.303 . . . . 0.0 110.677 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.7 t -47.3 -51.91 17.8 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.809 0.693 . . . . 0.0 110.873 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.65 ' SD ' ' HA ' ' A' ' 27' ' ' LEU . 8.5 mmt -74.79 -33.26 62.21 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.955 0.502 . . . . 0.0 111.573 178.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 67.0 ttt180 -60.13 -29.27 68.52 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.163 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.4 m -101.55 -52.94 3.1 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.493 0.496 . . . . 0.0 110.824 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.41 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -102.7 28.8 5.78 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -178.467 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.464 ' HA2' ' HE3' ' A' ' 50' ' ' MET . . . . . . . . 0 N--CA 1.459 0.168 0 O-C-N 121.789 -0.569 . . . . 0.0 112.506 179.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.3 t70 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.517 0.199 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.668 ' HB2' ' O ' ' A' ' 40' ' ' ARG . 4.3 p90 -128.28 -6.9 5.34 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.784 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.596 ' HB3' ' HB3' ' A' ' 21' ' ' TYR . 57.0 m -72.88 -50.99 20.43 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -84.16 43.53 0.95 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.427 0.632 . . . . 0.0 112.014 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -127.17 153.77 76.79 Favored Pre-proline 0 CA--C 1.537 0.476 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.446 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.95 134.77 41.32 Favored 'Trans proline' 0 C--N 1.371 1.725 0 C-N-CA 122.549 2.166 . . . . 0.0 113.396 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -57.87 141.02 95.71 Favored 'Trans proline' 0 C--N 1.372 1.776 0 C-N-CA 123.659 2.906 . . . . 0.0 113.86 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -117.06 102.38 9.28 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.463 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.0 m -95.93 -83.0 0.38 Allowed 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.73 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.14 137.64 8.29 Favored Glycine 0 C--N 1.341 0.824 0 CA-C-O 118.933 -0.926 . . . . 0.0 110.946 -178.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.05 83.16 0.26 Allowed 'Trans proline' 0 C--N 1.37 1.685 0 C-N-CA 122.802 2.334 . . . . 0.0 112.847 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.6 m -138.2 -167.6 2.2 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.33 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -99.7 72.5 1.75 Allowed 'General case' 0 C--O 1.238 0.476 0 CA-C-O 122.195 0.998 . . . . 0.0 108.834 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.78 ' HB3' ' HA3' ' A' ' 34' ' ' GLY . . . -77.45 -55.63 5.22 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 113.901 -1.5 . . . . 0.0 113.104 -177.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.562 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.3 OUTLIER 46.95 22.39 0.2 Allowed 'General case' 0 N--CA 1.497 1.884 0 C-N-CA 124.523 1.129 . . . . 0.0 113.792 -179.57 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.564 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 27.4 mt -135.76 142.02 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.431 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.874 HG13 HG21 ' A' ' 32' ' ' VAL . 4.5 mp -121.23 108.61 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 122.131 0.967 . . . . 0.0 108.952 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 1.023 ' HG2' ' HA ' ' A' ' 44' ' ' LYS . 27.2 mtt180 -86.5 -167.02 1.72 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 113.116 -1.857 . . . . 0.0 111.507 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.531 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 42.4 m-85 -128.91 151.16 49.95 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.622 ' HA ' ' CB ' ' A' ' 42' ' ' ASN . 3.8 p90 -147.52 155.52 41.95 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.294 0.371 . . . . 0.0 110.669 178.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.622 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 14.9 t80 -83.7 116.89 22.88 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -178.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.589 ' C ' ' H ' ' A' ' 24' ' ' LYS . 3.2 m120 -110.56 91.11 3.53 Favored 'General case' 0 C--O 1.246 0.902 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.253 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.02 15.86 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 120.944 0.402 . . . . 0.0 111.693 -179.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.589 ' H ' ' C ' ' A' ' 22' ' ' ASN . 46.5 tptt -97.78 -37.97 9.65 Favored 'General case' 0 C--N 1.345 0.372 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.85 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -99.18 -15.27 18.99 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.073 179.092 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.02 13.28 72.11 Favored Glycine 0 C--N 1.349 1.265 0 N-CA-C 114.663 0.625 . . . . 0.0 114.663 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.85 HD22 ' HB2' ' A' ' 25' ' ' ALA . 2.2 pt? -154.3 -176.01 5.67 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 117.307 0.554 . . . . 0.0 111.378 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 31.5 m -84.6 156.38 21.61 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.989 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.617 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 56.1 tp60 -134.78 153.78 51.88 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-O 120.961 0.41 . . . . 0.0 110.395 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -78.26 122.97 26.41 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.43 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.72 ' O ' ' N ' ' A' ' 18' ' ' ARG . 3.0 p90 -141.91 142.07 33.02 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.49 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.874 HG21 HG13 ' A' ' 17' ' ' ILE . 48.3 t -78.01 126.76 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 123.984 0.914 . . . . 0.0 111.462 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -112.23 131.8 55.29 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.168 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.78 ' HA3' ' HB3' ' A' ' 14' ' ' ALA . . . -89.64 153.59 23.36 Favored Glycine 0 C--N 1.34 0.801 0 O-C-N 123.701 0.625 . . . . 0.0 113.238 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.31 8.89 69.62 Favored Glycine 0 C--N 1.338 0.656 0 O-C-N 123.82 0.364 . . . . 0.0 113.162 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.2 p -94.94 -43.83 7.99 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 122.503 0.321 . . . . 0.0 110.876 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.3 mtt-85 -119.27 124.47 46.78 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.942 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -111.59 138.07 48.62 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.899 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.565 ' HZ1' ' H ' ' A' ' 40' ' ' ARG . 0.5 OUTLIER -142.98 -170.72 3.31 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.859 179.575 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . 0.668 ' O ' ' HB2' ' A' ' 2' ' ' PHE . 80.4 mmt-85 -121.62 91.31 3.49 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.574 ' O ' ' HD1' ' A' ' 2' ' ' PHE . 46.3 t30 -107.57 -52.59 2.74 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.972 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.622 ' CB ' ' HA ' ' A' ' 20' ' ' PHE . 1.1 m120 -160.82 -103.01 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.447 0.467 . . . . 0.0 110.431 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -150.96 -173.8 4.6 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -177.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 1.023 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 12.5 tppt? -97.79 -42.24 7.68 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.688 177.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.5 m -108.86 155.32 20.95 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.906 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.35 80.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.92 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -54.35 -50.94 66.27 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.701 0.4 . . . . 0.0 111.643 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -70.52 -52.33 22.56 Favored 'General case' 0 C--N 1.345 0.39 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.969 178.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.432 ' SG ' ' ND2' ' A' ' 42' ' ' ASN . 41.9 t -49.5 -34.59 17.48 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.187 0.595 . . . . 0.0 112.309 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.606 ' HA ' ' HA2' ' A' ' 54' ' ' GLY . 59.0 mtt -78.77 -47.16 17.32 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 122.941 0.496 . . . . 0.0 111.607 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -58.05 -33.32 68.9 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 123.799 0.687 . . . . 0.0 111.58 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.9 m -86.22 -55.16 4.05 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.622 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 2.2 p -149.61 74.25 1.22 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.059 0.457 . . . . 0.0 112.118 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.606 ' HA2' ' HA ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.339 0.715 0 C-N-CA 121.199 -0.525 . . . . 0.0 112.728 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 120.505 0.193 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.469 ' HE1' ' CZ ' ' A' ' 43' ' ' PHE . 1.3 p90 -125.93 -26.06 3.51 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.044 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.542 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 24.9 t -86.67 -14.15 43.42 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.222 0.326 . . . . 0.0 111.807 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.511 HD23 ' CE2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -79.67 -8.69 59.37 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 179.966 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -95.6 157.54 35.94 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -70.58 167.73 24.66 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.85 2.366 . . . . 0.0 112.523 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.469 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 37.9 Cg_endo -58.25 132.92 51.85 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 123.257 2.638 . . . . 0.0 112.968 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -92.72 -0.53 57.26 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 32' ' ' VAL . 8.7 m -40.87 -22.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.901 0.88 . . . . 0.0 113.218 -179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 55.65 -150.92 20.75 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-O 119.409 -0.662 . . . . 0.0 113.511 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -81.9 13.17 2.56 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 123.159 2.573 . . . . 0.0 112.484 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.5 m -84.89 154.58 22.15 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.889 -179.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -133.32 73.42 1.51 Allowed 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.341 0.591 . . . . 0.0 111.19 -179.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.72 ' HB3' HH21 ' A' ' 15' ' ' ARG . . . -86.92 172.26 10.18 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.411 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.801 ' H ' ' HE ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -110.79 45.14 1.18 Allowed 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.015 0.436 . . . . 0.0 111.521 -179.414 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.836 HG21 ' HZ2' ' A' ' 44' ' ' LYS . 25.3 mt -131.81 92.08 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 1.047 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.1 mp -76.24 144.25 12.07 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-O 121.565 0.697 . . . . 0.0 110.131 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.92 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 68.1 mtt180 -150.56 -178.23 6.43 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.41 -177.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.819 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 1.5 m-85 -123.31 152.98 40.88 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.469 ' CE2' ' HD3' ' A' ' 7' ' ' PRO . 8.1 p90 -144.76 168.7 19.58 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 124.054 0.846 . . . . 0.0 109.582 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.66 ' CD2' ' HB2' ' A' ' 53' ' ' CYS . 3.8 t80 -106.86 128.87 54.66 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' LYS . 69.1 m-80 -105.97 109.95 22.07 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 175.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.79 21.3 0.68 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.249 0.547 . . . . 0.0 110.805 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' ASN . 12.7 tppt? -96.19 -23.74 16.58 Favored 'General case' 0 C--N 1.345 0.405 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.522 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -127.52 -31.15 2.52 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.198 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.423 ' HA3' ' HE1' ' A' ' 21' ' ' TYR . . . 95.44 31.29 7.6 Favored Glycine 0 C--N 1.344 0.978 0 O-C-N 123.391 0.432 . . . . 0.0 112.292 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 pp -135.72 163.53 29.96 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-O 121.007 0.432 . . . . 0.0 111.896 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.819 ' SG ' ' HB3' ' A' ' 19' ' ' TYR . 48.9 t -98.5 119.01 36.47 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.625 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.432 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 3.5 tm0? -96.16 153.01 18.03 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.563 -178.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.456 HG23 ' CZ ' ' A' ' 19' ' ' TYR . 46.2 p -90.38 123.11 33.85 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.019 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.443 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 2.6 p90 -143.08 138.05 29.63 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.701 -179.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 1.047 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.0 t -80.21 88.43 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.524 1.13 . . . . 0.0 113.009 -178.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.487 ' HB3' ' HD2' ' A' ' 18' ' ' ARG . 25.0 t80 -52.27 125.38 15.74 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.962 0.505 . . . . 0.0 110.995 178.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.475 ' HA3' ' CB ' ' A' ' 14' ' ' ALA . . . -83.26 150.46 27.34 Favored Glycine 0 C--N 1.34 0.789 0 CA-C-N 115.871 -0.604 . . . . 0.0 113.495 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.41 23.61 23.97 Favored Glycine 0 C--N 1.339 0.716 0 O-C-N 123.785 0.344 . . . . 0.0 112.898 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.9 p -95.06 -46.93 6.6 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.526 0.33 . . . . 0.0 110.451 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -126.57 126.58 43.89 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.65 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -100.93 131.42 46.81 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -145.54 165.14 29.5 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.052 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 46.9 mmm-85 -78.3 1.63 21.14 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.823 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.602 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.2 OUTLIER -89.8 72.61 7.6 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 120.924 0.393 . . . . 0.0 110.431 179.339 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.92 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 74.4 m-80 -156.7 133.69 10.37 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.718 179.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.524 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 31.9 m-85 -137.78 101.77 4.55 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.991 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.836 ' HZ2' HG21 ' A' ' 16' ' ' ILE . 51.6 mmtt -67.13 -22.85 65.77 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.9 m -113.76 133.31 55.45 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.763 0.316 . . . . 0.0 111.834 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.93 -47.59 77.15 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.915 179.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -48.14 -56.77 7.04 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 123.918 0.761 . . . . 0.0 110.661 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . 0.681 ' HA ' ' HG2' ' A' ' 51' ' ' ARG . 57.1 m-20 -58.99 -49.66 77.04 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 122.608 0.363 . . . . 0.0 110.588 178.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.5 t -46.4 -49.74 17.59 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 123.934 0.771 . . . . 0.0 111.135 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 96.0 mtp -68.9 -43.55 75.02 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.681 ' HG2' ' HA ' ' A' ' 48' ' ' ASP . 33.3 ptt180 -70.21 -16.19 63.02 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.8 m -102.94 -49.56 3.75 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 123.209 0.318 . . . . 0.0 110.604 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.66 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 1.3 p -123.48 34.81 5.0 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.459 0.197 0 C-N-CA 121.083 -0.58 . . . . 0.0 112.458 179.884 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . 0.494 ' OD2' HD23 ' A' ' 4' ' ' LEU . 47.8 t0 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.553 0.216 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -128.5 -173.21 2.9 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.104 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 26.4 t 70.64 -47.9 0.65 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.705 1.202 . . . . 0.0 112.796 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.532 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 3.7 pp -81.85 -6.38 59.03 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . 0.45 ' HB3' ' HD2' ' A' ' 6' ' ' PRO . 55.2 mm-40 -87.32 163.85 37.89 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.562 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' A' ' 5' ' ' GLU . 13.7 Cg_endo -56.36 130.12 38.42 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.555 2.17 . . . . 0.0 113.223 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.532 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 21.4 Cg_endo -52.71 136.04 57.7 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 124.121 3.214 . . . . 0.0 114.408 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -130.1 117.49 20.05 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.612 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.406 HG21 ' HA ' ' A' ' 33' ' ' TYR . 41.2 m -96.28 -71.94 0.65 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.378 179.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.459 ' HA2' ' CB ' ' A' ' 37' ' ' ARG . . . 112.03 147.66 10.58 Favored Glycine 0 C--N 1.34 0.775 0 CA-C-O 119.146 -0.808 . . . . 0.0 111.511 -178.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.401 ' HD3' ' HA3' ' A' ' 10' ' ' GLY . 2.7 Cg_exo -76.4 49.12 2.54 Favored 'Trans proline' 0 C--N 1.368 1.553 0 C-N-CA 122.882 2.388 . . . . 0.0 113.055 -179.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . 0.653 ' HB2' ' HG2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -146.53 133.04 19.73 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.309 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.693 ' HE2' ' H ' ' A' ' 13' ' ' LYS . 0.4 OUTLIER 28.99 47.28 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 125.196 1.398 . . . . 0.0 114.549 178.796 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.668 ' HA ' ' HA3' ' A' ' 34' ' ' GLY . . . -89.52 100.25 13.09 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.913 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -155.54 30.56 0.38 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.386 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.551 ' O ' HG11 ' A' ' 32' ' ' VAL . 46.8 mt -143.07 128.92 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.692 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.792 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.2 mp -93.66 142.8 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.648 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 37.8 mtt180 -137.19 -176.24 4.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.678 -177.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.527 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.1 m-85 -116.64 148.03 41.36 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.686 0.279 . . . . 0.0 111.584 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.794 ' HB2' HD22 ' A' ' 41' ' ' ASN . 2.9 p90 -139.54 155.63 47.39 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.577 ' CZ ' ' HA3' ' A' ' 26' ' ' GLY . 68.4 t80 -90.38 131.97 35.86 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -99.87 130.46 46.06 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 176.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.39 9.93 27.06 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 123.349 0.406 . . . . 0.0 111.781 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -97.61 -24.74 15.39 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.048 179.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -134.97 -28.93 1.15 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.672 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . 0.577 ' HA3' ' CZ ' ' A' ' 21' ' ' TYR . . . 95.95 8.62 57.89 Favored Glycine 0 C--N 1.342 0.914 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.297 -178.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 pp -95.7 151.61 19.21 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 123.834 0.373 . . . . 0.0 111.901 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 96.4 m -96.13 109.97 22.32 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.124 178.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.574 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 53.4 tp60 -92.15 156.94 17.0 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.031 -177.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.455 HG23 ' CE1' ' A' ' 19' ' ' TYR . 34.0 p -89.78 128.37 36.13 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.294 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 6.9 p90 -150.66 150.52 31.23 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.796 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.792 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.2 t -76.74 161.35 4.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 123.656 0.783 . . . . 0.0 112.395 -177.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.489 ' N ' ' O ' ' A' ' 16' ' ' ILE . 32.7 t80 -136.85 158.17 45.08 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.904 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.668 ' HA3' ' HA ' ' A' ' 14' ' ' ALA . . . -105.76 -164.33 23.31 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 121.146 -0.549 . . . . 0.0 113.324 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . 0.51 ' HA2' ' HB2' ' A' ' 13' ' ' LYS . . . -109.47 -60.83 0.52 Allowed Glycine 0 C--N 1.339 0.699 0 O-C-N 123.788 0.346 . . . . 0.0 112.716 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . 0.549 ' SG ' ' HD2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -80.05 -19.56 47.31 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 179.757 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.653 ' HG2' ' HB2' ' A' ' 12' ' ' CYS . 71.9 mmt-85 -96.85 102.95 14.82 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.053 0.454 . . . . 0.0 110.851 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -120.42 148.49 43.72 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.569 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.9 tmtp? -137.13 -124.78 0.14 Allowed 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.482 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -143.99 -1.24 0.98 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.781 0.433 . . . . 0.0 111.622 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.794 HD22 ' HB2' ' A' ' 20' ' ' PHE . 0.2 OUTLIER -109.15 78.48 1.14 Allowed 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.807 0.337 . . . . 0.0 111.737 -179.058 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.648 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 9.3 m120 -155.63 123.89 5.85 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.81 177.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.522 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 36.5 m-85 -134.65 103.32 5.61 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.138 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.406 ' HG2' ' HG2' ' A' ' 18' ' ' ARG . 6.5 tmtt? -74.31 0.62 13.73 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.2 m -134.92 134.22 40.4 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.269 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.93 -45.99 86.75 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.295 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -49.11 -55.96 10.6 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.781 0.676 . . . . 0.0 110.786 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -62.53 -47.45 83.84 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 122.398 0.279 . . . . 0.0 110.763 178.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.506 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 53.7 t -46.68 -48.96 20.0 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 123.824 0.702 . . . . 0.0 111.37 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.5 mtt -73.69 -39.26 64.51 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 86.8 mtm180 -69.13 -19.76 64.03 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.5 m -105.72 -51.49 2.99 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 122.983 0.177 . . . . 0.0 110.841 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.506 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.2 OUTLIER -109.42 21.04 17.55 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -178.681 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.755 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.545 178.589 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 N--CA 1.488 1.468 0 CA-C-O 120.519 0.2 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -127.82 -164.87 1.41 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.238 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . 0.702 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 13.9 t 72.51 -39.66 0.45 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.808 1.243 . . . . 0.0 112.35 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . 0.421 HD22 ' CD1' ' A' ' 21' ' ' TYR . 23.1 mt -79.51 -4.95 53.67 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -95.14 151.37 38.74 Favored Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.198 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.18 169.34 15.43 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.927 2.418 . . . . 0.0 112.908 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . 0.571 ' HD3' ' CZ ' ' A' ' 20' ' ' PHE . 36.5 Cg_endo -57.81 130.01 36.35 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 123.037 2.491 . . . . 0.0 113.101 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.941 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 9.9 t80 -95.22 -19.76 19.77 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.592 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.6 m -8.94 -80.67 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.613 0.765 . . . . 0.0 109.609 -176.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.39 -159.47 19.01 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.611 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -78.72 13.07 2.0 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 123.073 2.515 . . . . 0.0 113.143 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.6 m -94.85 -59.53 1.89 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.928 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt 57.51 91.23 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.095 0.958 . . . . 0.0 112.33 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.624 ' HB1' ' HA3' ' A' ' 34' ' ' GLY . . . -80.98 -158.33 0.2 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.402 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.68 37.71 4.25 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.071 0.462 . . . . 0.0 111.814 -179.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.0 mt -129.96 91.74 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.712 -179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.671 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 2.9 mp -76.39 153.87 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.079 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.609 HH11 ' ND2' ' A' ' 42' ' ' ASN . 39.2 mtt180 -154.8 -179.59 8.17 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.625 -177.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.739 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 2.2 m-85 -112.39 156.91 21.72 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-N 118.32 0.509 . . . . 0.0 111.731 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.571 ' CZ ' ' HD3' ' A' ' 7' ' ' PRO . 1.8 p90 -158.56 167.05 30.63 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 124.597 1.186 . . . . 0.0 108.981 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.702 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 5.5 t80 -81.71 133.8 35.39 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 118.419 0.554 . . . . 0.0 112.166 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.553 ' ND2' ' HB3' ' A' ' 29' ' ' GLN . 67.8 m-80 -141.27 112.88 7.61 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.104 178.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.92 7.28 4.99 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.0 177.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . 0.402 ' H ' ' C ' ' A' ' 22' ' ' ASN . 18.4 ttmm -96.87 -41.04 8.63 Favored 'General case' 0 C--N 1.348 0.537 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.017 179.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.44 -48.05 9.37 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.981 179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 169.49 -62.54 0.18 Allowed Glycine 0 C--N 1.336 0.576 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.659 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.725 HD11 ' N ' ' A' ' 28' ' ' CYS . 2.3 pp -150.62 -52.49 0.14 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.368 0.267 . . . . 0.0 110.822 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . 0.725 ' N ' HD11 ' A' ' 27' ' ' LEU . 58.5 m -133.86 144.64 49.05 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.538 0.335 . . . . 0.0 110.24 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.553 ' HB3' ' ND2' ' A' ' 22' ' ' ASN . 63.3 tp60 -145.81 159.23 43.5 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.405 0.622 . . . . 0.0 112.273 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . 0.513 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 34.9 p -77.54 142.28 39.12 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 113.946 -1.479 . . . . 0.0 112.244 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.599 ' O ' ' HA ' ' A' ' 17' ' ' ILE . 6.7 p90 -152.64 147.35 26.04 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.388 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.671 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.2 t -99.13 110.37 26.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.241 0.617 . . . . 0.0 111.363 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -78.49 136.07 37.5 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . 0.624 ' HA3' ' HB1' ' A' ' 14' ' ' ALA . . . -92.59 155.59 22.75 Favored Glycine 0 C--N 1.338 0.664 0 O-C-N 123.561 0.538 . . . . 0.0 112.906 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -98.66 11.95 62.87 Favored Glycine 0 C--N 1.337 0.625 0 C-N-CA 121.433 -0.413 . . . . 0.0 113.346 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 17.5 p -95.14 -44.61 7.56 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.771 0.285 . . . . 0.0 110.73 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -124.76 153.49 42.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.025 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -100.6 151.02 22.1 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.276 0.56 . . . . 0.0 112.161 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.941 ' HD3' ' HB3' ' A' ' 8' ' ' TYR . 13.0 ttpp -134.07 165.18 25.66 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.356 -179.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 86.4 mtm180 -112.47 18.7 18.23 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.648 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.851 ' H ' ' HG2' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -126.96 97.45 4.97 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.172 0.51 . . . . 0.0 110.936 179.751 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.609 ' ND2' HH11 ' A' ' 18' ' ' ARG . 8.3 m120 -146.23 147.93 31.95 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.543 178.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.739 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 56.1 m-85 -160.53 81.19 0.67 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.759 0.662 . . . . 0.0 109.853 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . 0.526 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 20.2 tptm -43.25 -28.04 0.28 Allowed 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -178.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.4 m -136.65 154.91 50.51 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.666 0.269 . . . . 0.0 111.636 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.62 -50.62 73.17 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.51 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 51' ' ' ARG . 71.8 tt0 -43.63 -51.13 7.18 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.931 0.77 . . . . 0.0 110.474 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -66.07 -39.14 89.82 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.42 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.476 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 41.9 t -55.5 -59.24 5.11 Favored 'General case' 0 C--N 1.355 0.843 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' MET . . . . . 0.516 ' HA ' ' HA2' ' A' ' 54' ' ' GLY . 66.9 mtt -60.97 -31.96 71.52 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 122.884 0.474 . . . . 0.0 111.011 177.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 5.4 tmm_? -58.11 -41.94 84.65 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.57 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.481 ' HB ' ' CZ ' ' A' ' 43' ' ' PHE . 7.6 m -101.24 -51.31 3.54 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.13 12.04 37.4 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -178.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . 0.516 ' HA2' ' HA ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.341 0.841 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.581 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.532 0.206 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' PHE . . . . . 0.492 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 2.5 p90 -104.57 -29.76 10.44 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.926 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -83.57 -35.69 24.54 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -80.54 -8.18 59.49 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.547 179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -112.26 155.39 43.65 Favored Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.395 179.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -61.52 142.83 96.3 Favored 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 122.706 2.27 . . . . 0.0 113.392 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -61.56 165.35 13.61 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 123.522 2.815 . . . . 0.0 113.395 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . 0.709 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 15.1 t80 -125.57 35.18 4.77 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.623 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.523 HG22 ' O ' ' A' ' 32' ' ' VAL . 7.0 m -57.92 -41.69 83.22 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.093 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' GLY . . . . . 0.621 ' HA2' ' NE ' ' A' ' 37' ' ' ARG . . . 70.91 -165.17 53.14 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.318 -0.712 . . . . 0.0 113.027 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PRO . . . . . 0.425 ' HD3' HH21 ' A' ' 37' ' ' ARG . 3.0 Cg_exo -80.83 16.75 1.54 Allowed 'Trans proline' 0 C--N 1.368 1.566 0 C-N-CA 123.052 2.501 . . . . 0.0 112.824 179.433 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.77 114.86 22.78 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.624 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -142.04 83.23 1.83 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.154 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . 0.519 ' HB2' ' HD3' ' A' ' 15' ' ' ARG . . . -78.44 -104.44 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ARG . . . . . 0.556 ' HD3' ' N ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -137.98 34.36 2.37 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.044 0.45 . . . . 0.0 112.197 -178.428 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ILE . . . . . 0.521 ' HB ' ' O ' ' A' ' 33' ' ' TYR . 23.1 mt -127.54 61.92 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-O 121.801 0.81 . . . . 0.0 109.62 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ILE . . . . . 0.918 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.5 mp -69.82 126.7 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.57 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ARG . . . . . 0.957 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 71.2 mtt180 -127.64 -179.73 5.08 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 113.032 -1.895 . . . . 0.0 108.805 -179.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' TYR . . . . . 0.67 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.5 m-85 -111.45 153.92 25.43 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -177.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . 0.579 ' CE2' ' HB3' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -142.98 145.15 32.69 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 178.465 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' TYR . . . . . 0.462 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 44.9 t80 -101.39 119.21 38.41 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' ASN . . . . . 0.407 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 0.2 OUTLIER -80.21 93.72 5.92 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.768 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.9 -13.32 2.54 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 tttm -95.55 -34.65 11.95 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 118.401 0.546 . . . . 0.0 110.942 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' ALA . . . . . 0.905 ' HB1' HD12 ' A' ' 27' ' ' LEU . . . -79.62 -31.42 41.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.914 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.6 -15.23 61.26 Favored Glycine 0 C--N 1.34 0.785 0 O-C-N 123.414 0.446 . . . . 0.0 112.999 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LEU . . . . . 0.905 HD12 ' HB1' ' A' ' 25' ' ' ALA . 0.0 OUTLIER -115.55 170.64 8.27 Favored 'General case' 0 C--O 1.244 0.764 0 CA-C-O 121.141 0.496 . . . . 0.0 112.122 -179.395 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.5 t -93.55 157.64 16.09 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.154 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' GLN . . . . . 0.579 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 25.2 tt0 -144.88 130.95 19.37 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.172 -178.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.3 p -77.33 139.65 39.82 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PHE . . . . . 0.616 ' O ' ' N ' ' A' ' 18' ' ' ARG . 18.4 p90 -138.13 159.41 42.1 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.625 179.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' VAL . . . . . 0.918 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.1 t -97.89 164.52 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 123.643 0.777 . . . . 0.0 110.512 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.521 ' O ' ' HB ' ' A' ' 16' ' ' ILE . 45.3 t80 -137.49 157.21 47.04 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.693 179.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.14 -167.11 19.38 Favored Glycine 0 C--N 1.337 0.628 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.027 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.72 12.57 69.06 Favored Glycine 0 C--N 1.34 0.775 0 C-N-CA 121.609 -0.329 . . . . 0.0 113.185 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.99 -34.75 12.24 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 122.761 0.425 . . . . 0.0 112.007 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' ARG . . . . . 0.621 ' NE ' ' HA2' ' A' ' 10' ' ' GLY . 87.2 mtt-85 -132.36 150.95 52.05 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.22 0.325 . . . . 0.0 110.513 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -142.98 118.04 10.07 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.414 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.709 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 0.2 OUTLIER -148.42 174.93 11.56 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.228 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -75.97 -51.28 12.74 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.16 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASN . . . . . 0.492 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -53.49 92.28 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.405 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ASN . . . . . 0.957 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 8.5 m120 -157.78 109.22 2.28 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 114.559 -1.201 . . . . 0.0 108.914 177.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PHE . . . . . 0.67 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 0.7 OUTLIER -97.42 -168.53 1.7 Allowed 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -176.655 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.93 -68.58 0.82 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 113.242 -1.799 . . . . 0.0 112.609 178.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' SER . . . . . 0.439 ' HA ' ' CE2' ' A' ' 19' ' ' TYR . 52.6 m -154.43 177.35 11.26 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.268 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.32 -37.32 72.32 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.48 -54.46 46.35 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 123.356 0.41 . . . . 0.0 111.187 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -73.23 -31.73 64.32 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.603 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' CYS . . . . . 0.432 ' HA ' ' CE2' ' A' ' 43' ' ' PHE . 7.6 t -58.94 -40.8 85.76 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.374 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 74.0 mtm -84.03 -34.21 24.33 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 123.627 0.579 . . . . 0.0 110.533 178.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -54.6 -38.14 66.42 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.705 178.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' THR . . . . . 0.491 ' HB ' ' HZ ' ' A' ' 43' ' ' PHE . 11.5 m -100.37 -48.04 4.71 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.57 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' CYS . . . . . 0.462 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -116.1 55.16 0.81 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -179.145 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.475 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.48 179.277 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 120.55 0.214 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.466 ' HB2' ' HA ' ' A' ' 41' ' ' ASN . 0.4 OUTLIER -129.7 52.03 2.03 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.376 0.608 . . . . 0.0 111.314 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.0 t -128.93 -51.07 1.22 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.733 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -100.58 8.44 43.44 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 123.47 0.481 . . . . 0.0 112.135 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.456 ' HB2' ' OD1' ' A' ' 41' ' ' ASN . 55.3 mm-40 -89.87 141.2 28.01 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.121 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.434 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 4.2 Cg_exo -75.7 159.37 38.88 Favored 'Trans proline' 0 C--N 1.369 1.613 0 C-N-CA 123.107 2.538 . . . . 0.0 113.085 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.56 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 58.7 Cg_endo -63.1 148.12 93.62 Favored 'Trans proline' 0 C--N 1.37 1.709 0 C-N-CA 123.518 2.812 . . . . 0.0 113.619 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -107.8 45.9 0.98 Allowed 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.39 0.614 . . . . 0.0 110.83 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.625 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 21.8 m -54.17 -48.25 71.11 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.755 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 54.66 -150.89 16.19 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-O 119.291 -0.727 . . . . 0.0 113.22 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -87.84 15.74 2.06 Favored 'Trans proline' 0 C--N 1.366 1.45 0 C-N-CA 122.968 2.446 . . . . 0.0 113.344 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -140.87 120.17 13.03 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.422 0.289 . . . . 0.0 111.541 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.745 ' HE2' ' HA ' ' A' ' 33' ' ' TYR . 2.1 tptm -179.16 108.28 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.969 1.308 . . . . 0.0 108.114 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.462 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -76.66 -141.82 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.881 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -104.45 46.1 0.93 Allowed 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.168 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.534 ' O ' HG11 ' A' ' 32' ' ' VAL . 19.0 mt -129.0 90.59 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.742 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 1.031 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.2 mp -76.5 144.67 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-O 121.73 0.776 . . . . 0.0 110.58 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.723 ' HG2' ' HA ' ' A' ' 44' ' ' LYS . 4.8 ttt180 -134.2 -160.32 1.04 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 113.633 -1.621 . . . . 0.0 110.237 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -132.78 147.24 52.31 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.648 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 6.2 p90 -144.97 141.94 29.39 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.561 ' CE2' ' HG2' ' A' ' 50' ' ' MET . 17.3 t80 -84.47 120.7 26.61 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.747 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 0.7 OUTLIER -97.0 95.85 8.09 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.362 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.88 -14.17 0.19 Allowed 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -178.197 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -95.91 -26.66 15.51 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 117.536 0.153 . . . . 0.0 111.214 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.747 ' HB3' ' HB2' ' A' ' 22' ' ' ASN . . . -85.1 -44.84 12.64 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.515 0.509 . . . . 0.0 111.689 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.69 -8.34 25.95 Favored Glycine 0 C--N 1.343 0.923 0 C-N-CA 121.25 -0.5 . . . . 0.0 113.495 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.597 HD11 ' N ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -141.56 175.31 9.78 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.947 0.374 . . . . 0.0 111.708 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.505 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 94.4 m -94.42 102.89 14.87 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.635 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.5 tp60 -79.76 148.36 31.5 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.644 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.464 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 40.7 p -78.41 121.95 25.18 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.076 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.691 ' O ' ' N ' ' A' ' 18' ' ' ARG . 5.5 p90 -138.83 154.03 48.41 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 114.195 -1.366 . . . . 0.0 108.253 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 1.031 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 14.3 t -76.94 163.7 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 CA-C-N 118.508 0.595 . . . . 0.0 112.407 -178.071 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.745 ' HA ' ' HE2' ' A' ' 13' ' ' LYS . 55.3 t80 -117.5 146.54 43.47 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.099 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -119.12 151.16 17.72 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 120.996 -0.621 . . . . 0.0 113.213 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.16 -15.01 46.36 Favored Glycine 0 C--N 1.339 0.702 0 O-C-N 123.86 0.388 . . . . 0.0 112.733 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.94 -34.85 17.97 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 122.704 0.402 . . . . 0.0 111.693 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -97.34 -72.06 0.66 Allowed 'General case' 0 CA--C 1.536 0.411 0 O-C-N 123.233 0.333 . . . . 0.0 110.443 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 47.55 117.95 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.581 1.152 . . . . 0.0 113.888 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -131.74 -173.17 3.06 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.26 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -75.53 -47.81 25.26 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.448 -177.312 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.598 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.2 OUTLIER -69.98 76.57 0.48 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.217 0.532 . . . . 0.0 111.627 -179.523 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -154.74 128.51 8.69 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.095 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.54 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 56.9 m-85 -129.97 135.21 48.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.137 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.723 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 3.2 tppp? -80.1 -38.89 30.73 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 123.267 0.354 . . . . 0.0 111.872 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.8 m -111.87 138.53 48.35 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 123.234 0.334 . . . . 0.0 111.661 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.63 -31.62 72.85 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.709 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.4 mp0 -63.56 -56.9 12.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.347 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -68.75 -24.13 64.41 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.156 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.54 ' HA ' ' CD2' ' A' ' 43' ' ' PHE . 43.4 t -66.81 -54.86 18.2 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.659 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.561 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 96.7 mtp -73.26 -30.36 63.39 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.091 0.557 . . . . 0.0 112.218 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -74.0 -37.68 64.34 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 123.282 0.364 . . . . 0.0 111.693 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.401 ' HB ' ' CE2' ' A' ' 43' ' ' PHE . 20.4 m -85.91 -33.81 21.11 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 123.129 0.268 . . . . 0.0 111.436 -179.723 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.492 ' HB3' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -87.02 -50.11 6.87 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 121.24 -0.184 . . . . 0.0 110.565 179.928 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -98.12 -101.15 2.16 Favored Glycine 0 C--N 1.341 0.856 0 O-C-N 123.443 0.464 . . . . 0.0 112.547 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 124.3 -54.88 0.72 Allowed Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.514 -0.374 . . . . 0.0 112.49 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.25 0 CA-C-O 118.105 -0.95 . . . . 0.0 112.308 -179.956 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.549 0.214 . . . . 0.0 111.119 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -104.85 -161.13 0.8 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.049 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.436 ' O ' ' HD2' ' A' ' 21' ' ' TYR . 42.2 t 73.82 -47.26 0.65 Allowed 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.443 1.097 . . . . 0.0 111.826 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -98.78 -12.86 20.5 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 123.188 0.305 . . . . 0.0 111.571 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.406 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 5.8 mm-40 -97.85 147.9 33.71 Favored Pre-proline 0 CA--C 1.537 0.446 0 O-C-N 123.258 0.349 . . . . 0.0 111.04 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.406 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 3.7 Cg_exo -78.04 165.13 26.54 Favored 'Trans proline' 0 C--N 1.369 1.631 0 C-N-CA 123.264 2.643 . . . . 0.0 112.949 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.552 ' HD3' ' CD1' ' A' ' 20' ' ' PHE . 50.0 Cg_endo -60.48 161.1 21.58 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 123.492 2.795 . . . . 0.0 113.085 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.448 ' CE2' ' HD2' ' A' ' 37' ' ' ARG . 10.3 t80 -125.83 36.27 4.56 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.45 ' OG1' ' HD2' ' A' ' 31' ' ' PHE . 11.8 m -62.04 -47.79 83.16 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 178.688 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.37 -161.03 53.51 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.704 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.46 42.1 1.19 Allowed 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 123.067 2.511 . . . . 0.0 112.572 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.4 m -92.35 -66.12 0.95 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.466 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? 66.03 98.18 0.05 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.016 0.927 . . . . 0.0 111.571 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.403 ' HB2' HH21 ' A' ' 15' ' ' ARG . . . -119.03 -175.05 2.83 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.535 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.797 ' H ' ' HE ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -109.0 38.24 2.34 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.163 0.506 . . . . 0.0 111.866 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 16.2 mt -138.52 71.41 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.384 179.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 1.066 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 13.1 tt -75.06 117.32 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-O 122.403 1.097 . . . . 0.0 111.48 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.761 ' N ' ' O ' ' A' ' 31' ' ' PHE . 54.4 mtt180 -100.28 -159.22 0.72 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 112.668 -2.06 . . . . 0.0 109.818 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.43 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 10.2 m-85 -125.5 164.23 20.95 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.736 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 7.1 p90 -158.13 164.31 36.74 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.894 -1.048 . . . . 0.0 108.994 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.631 ' HD1' ' SG ' ' A' ' 28' ' ' CYS . 63.1 t80 -108.9 110.28 21.56 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.62 HD22 ' HB2' ' A' ' 29' ' ' GLN . 0.2 OUTLIER -77.53 83.48 3.93 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.489 0.661 . . . . 0.0 109.916 -179.418 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -62.31 -2.62 1.05 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.213 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -96.95 -38.07 9.95 Favored 'General case' 0 C--N 1.346 0.452 0 C-N-CA 122.359 0.263 . . . . 0.0 110.763 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -87.04 -56.01 3.57 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.016 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 153.56 -55.81 0.43 Allowed Glycine 0 C--N 1.343 0.929 0 C-N-CA 121.295 -0.478 . . . . 0.0 112.453 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 pp -96.74 -175.16 3.21 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -178.337 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.631 ' SG ' ' HD1' ' A' ' 21' ' ' TYR . 89.1 m -98.67 139.62 34.1 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.271 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.62 ' HB2' HD22 ' A' ' 22' ' ' ASN . 0.1 OUTLIER -123.38 153.64 40.09 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 123.263 0.352 . . . . 0.0 110.625 -179.713 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.679 ' HB ' HG12 ' A' ' 17' ' ' ILE . 40.4 p -85.36 120.0 26.35 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.761 ' O ' ' N ' ' A' ' 18' ' ' ARG . 4.1 p90 -108.77 163.3 13.39 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 114.263 -1.335 . . . . 0.0 107.421 177.284 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 1.066 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 41.0 t -104.39 144.25 14.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 119.546 1.066 . . . . 0.0 109.71 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.567 ' HB2' ' HD2' ' A' ' 18' ' ' ARG . 39.0 t80 -115.07 124.66 52.15 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.007 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -125.45 -168.29 12.69 Favored Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.581 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -97.28 23.9 33.79 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 121.353 -0.451 . . . . 0.0 112.936 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 21.6 p -95.5 -44.05 7.69 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.281 0.233 . . . . 0.0 111.055 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.448 ' HD2' ' CE2' ' A' ' 8' ' ' TYR . 40.2 mmt180 -133.4 169.68 16.59 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.897 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -158.66 120.96 3.6 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.031 0.532 . . . . 0.0 110.084 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.409 ' CD ' ' H ' ' A' ' 40' ' ' ARG . 4.4 mmtp -141.65 -169.1 2.82 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.326 0.584 . . . . 0.0 112.082 -179.371 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.409 ' H ' ' CD ' ' A' ' 39' ' ' LYS . 24.8 mmm180 -76.23 -67.61 0.67 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.93 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.46 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.4 OUTLIER -44.9 99.6 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -178.448 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.504 ' ND2' HH11 ' A' ' 18' ' ' ARG . 7.5 m120 -151.37 139.28 19.95 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.947 178.552 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.736 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 97.7 m-85 -142.71 147.71 36.09 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.588 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -96.71 -44.04 7.28 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.643 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.4 m -133.9 165.07 25.85 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.416 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -62.36 -69.58 0.25 Allowed 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.052 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.483 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 67.7 tt0 -51.52 -37.01 47.27 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.813 0.445 . . . . 0.0 111.283 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 1.4 m-20 -69.0 -34.0 74.56 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.462 178.247 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.649 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 33.8 t -65.93 -46.19 79.15 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.005 178.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.448 ' SD ' ' SG ' ' A' ' 28' ' ' CYS . 1.4 mpt? -64.75 -52.29 57.77 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.931 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.483 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 46.0 ptt85 -64.34 -37.16 86.53 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -178.853 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 25.5 m -80.38 -31.52 37.76 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.588 ' SG ' ' CD2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -88.41 -63.18 1.34 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 119.454 -0.307 . . . . 0.0 111.502 -179.616 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.455 ' N ' ' SG ' ' A' ' 53' ' ' CYS . . . -137.15 70.65 0.49 Allowed Glycine 0 C--N 1.347 1.148 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.553 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -117.23 60.71 0.44 Allowed Glycine 0 C--N 1.337 0.62 0 C-N-CA 121.478 -0.391 . . . . 0.0 112.535 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.211 -0.899 . . . . 0.0 111.069 -179.918 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.476 0.179 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -96.14 7.74 45.62 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.028 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.412 ' O ' ' HB3' ' A' ' 23' ' ' ALA . 46.9 t -84.05 -24.0 30.61 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.008 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.481 ' HA ' ' CB ' ' A' ' 23' ' ' ALA . 4.1 mm? -116.86 -12.53 10.75 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.651 0.594 . . . . 0.0 111.471 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.407 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 5.8 mm-40 -96.52 144.37 27.73 Favored Pre-proline 0 N--CA 1.468 0.43 0 O-C-N 123.287 0.367 . . . . 0.0 111.154 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.407 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 4.9 Cg_exo -78.7 163.18 26.67 Favored 'Trans proline' 0 C--N 1.369 1.642 0 C-N-CA 123.293 2.662 . . . . 0.0 113.052 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.497 ' HD3' ' CE1' ' A' ' 20' ' ' PHE . 62.6 Cg_endo -64.25 168.84 11.83 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 123.498 2.798 . . . . 0.0 113.084 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.519 ' CZ ' ' HD3' ' A' ' 37' ' ' ARG . 7.2 t80 -129.27 1.16 5.15 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.3 m -44.22 -13.05 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.445 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . 49.46 -146.21 7.27 Favored Glycine 0 CA--C 1.535 1.327 0 N-CA-C 114.657 0.623 . . . . 0.0 114.657 177.67 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -83.43 4.72 6.84 Favored 'Trans proline' 0 C--N 1.37 1.698 0 C-N-CA 123.405 2.737 . . . . 0.0 113.487 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.4 136.61 33.79 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.1 82.74 2.04 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.867 -1.06 . . . . 0.0 109.798 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.828 ' HB2' HH21 ' A' ' 15' ' ' ARG . . . -78.57 -161.16 0.26 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.367 -1.288 . . . . 0.0 111.094 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.828 HH21 ' HB2' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -120.84 39.37 3.8 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.188 0.518 . . . . 0.0 111.358 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.535 ' HB ' ' O ' ' A' ' 33' ' ' TYR . 24.5 mt -134.97 75.66 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.061 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 1.037 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 21.2 mm -55.83 144.78 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 123.692 0.797 . . . . 0.0 110.837 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.532 HH12 ' HE3' ' A' ' 44' ' ' LYS . 14.4 mmt180 -149.11 171.63 16.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 113.679 -1.601 . . . . 0.0 110.166 -177.809 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.463 ' C ' ' HB2' ' A' ' 43' ' ' PHE . 4.3 m-85 -117.63 155.76 29.32 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 121.261 -0.176 . . . . 0.0 111.237 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.806 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 1.0 OUTLIER -146.68 152.86 39.55 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 123.643 0.589 . . . . 0.0 110.112 178.797 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.507 ' HB2' ' SG ' ' A' ' 49' ' ' CYS . 30.3 t80 -100.43 132.94 45.54 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.586 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -95.31 127.11 41.09 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.128 -0.694 . . . . 0.0 109.128 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.481 ' CB ' ' HA ' ' A' ' 4' ' ' LEU . . . -94.59 14.15 21.87 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.603 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -97.03 -23.1 16.43 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -136.77 -23.25 1.2 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.264 -179.27 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 97.69 -7.79 63.45 Favored Glycine 0 C--N 1.346 1.106 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.106 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.463 ' HA ' ' HE2' ' A' ' 50' ' ' MET . 3.4 pp -87.31 144.8 26.62 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 122.757 0.423 . . . . 0.0 111.759 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.485 ' H ' ' HE3' ' A' ' 50' ' ' MET . 78.3 m -92.19 142.3 27.64 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.832 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.522 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 2.5 tm0? -124.22 145.58 49.26 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.185 0.516 . . . . 0.0 111.835 -178.056 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.411 HG23 ' CZ ' ' A' ' 19' ' ' TYR . 39.8 p -85.4 143.11 28.81 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.509 -1.223 . . . . 0.0 111.826 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.547 ' CZ ' ' HB3' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -165.13 176.13 8.76 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.9 178.343 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 1.037 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 1.3 t -92.77 -162.07 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 124.32 1.048 . . . . 0.0 111.141 -178.791 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.691 ' HH ' ' HB1' ' A' ' 38' ' ' ALA . 65.4 t80 -174.33 144.15 0.91 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.631 1.173 . . . . 0.0 109.037 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.89 -160.55 9.59 Favored Glycine 0 C--N 1.337 0.602 0 C-N-CA 120.962 -0.637 . . . . 0.0 113.225 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -94.77 15.05 64.18 Favored Glycine 0 C--N 1.338 0.693 0 O-C-N 123.781 0.342 . . . . 0.0 113.406 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -48.03 7.47 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.519 ' HD3' ' CZ ' ' A' ' 8' ' ' TYR . 2.6 mmp_? -135.49 119.54 17.55 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.021 0.439 . . . . 0.0 111.498 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.691 ' HB1' ' HH ' ' A' ' 33' ' ' TYR . . . -118.46 119.38 34.4 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.635 179.242 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 9.8 tmtt? -124.43 -114.87 0.29 Allowed 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.824 -178.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 24.4 mmm180 -142.39 -33.37 0.48 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 122.657 0.383 . . . . 0.0 111.306 -179.852 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.477 ' ND2' ' HB2' ' A' ' 20' ' ' PHE . 0.4 OUTLIER -66.62 101.38 0.78 Allowed 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.696 0.76 . . . . 0.0 111.45 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -146.38 150.57 35.93 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 114.343 -1.299 . . . . 0.0 109.61 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.806 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 64.6 m-85 -153.36 165.35 36.05 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.811 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.532 ' HE3' HH12 ' A' ' 18' ' ' ARG . 13.8 mptt -99.02 -54.82 2.88 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.701 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.6 m -143.71 170.6 15.56 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.724 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.87 -46.79 87.9 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -52.17 -60.57 3.05 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.069 0.548 . . . . 0.0 110.941 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 52' ' ' THR . 49.0 m-20 -59.55 -53.44 58.11 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.316 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.634 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 28.5 t -40.28 -48.25 2.6 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.546 0.738 . . . . 0.0 111.961 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.485 ' HE3' ' H ' ' A' ' 28' ' ' CYS . 25.6 mmt -67.59 -47.11 70.68 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.854 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -79.3 -9.55 59.61 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 48' ' ' ASP . 40.2 m -91.67 -45.38 8.49 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.264 0.225 . . . . 0.0 110.586 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.64 -43.72 8.16 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 123.159 0.287 . . . . 0.0 110.802 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.78 -100.81 1.86 Allowed Glycine 0 C--N 1.345 1.043 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.716 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 147.42 55.28 0.02 OUTLIER Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.436 -0.412 . . . . 0.0 112.515 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.086 -179.984 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 120.55 0.214 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.4 ' HE1' ' HZ ' ' A' ' 43' ' ' PHE . 2.2 p90 -124.91 -167.22 1.64 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.17 -179.995 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.529 ' SG ' ' HB3' ' A' ' 21' ' ' TYR . 6.6 t 72.1 -36.24 0.35 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.728 1.211 . . . . 0.0 112.552 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.729 HD13 ' HB3' ' A' ' 23' ' ' ALA . 13.7 tp -80.05 -10.4 59.77 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 123.419 0.45 . . . . 0.0 111.844 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -95.75 152.59 39.18 Favored Pre-proline 0 CA--C 1.536 0.435 0 O-C-N 123.395 0.435 . . . . 0.0 110.374 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.92 149.46 90.13 Favored 'Trans proline' 0 C--N 1.368 1.602 0 C-N-CA 122.603 2.202 . . . . 0.0 113.166 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.434 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 31.1 Cg_endo -55.71 138.21 80.57 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 123.648 2.899 . . . . 0.0 113.476 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.571 ' O ' ' N ' ' A' ' 10' ' ' GLY . 1.6 t80 -91.18 8.11 37.36 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.568 0.543 . . . . 0.0 111.861 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.515 HG22 ' O ' ' A' ' 32' ' ' VAL . 10.6 m -30.04 -18.99 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 -178.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.571 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 5.86 110.91 0.0 OUTLIER Glycine 0 C--N 1.358 1.762 0 CA-C-O 118.41 -1.217 . . . . 0.0 114.488 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -23.06 87.1 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 124.953 3.769 . . . . 0.0 115.559 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.9 m -129.9 -157.49 0.82 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.283 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -98.6 71.61 1.98 Allowed 'General case' 0 C--O 1.239 0.543 0 CA-C-O 122.209 1.004 . . . . 0.0 108.318 178.753 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.852 ' HB1' HG13 ' A' ' 32' ' ' VAL . . . -100.16 128.02 46.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 113.688 -1.596 . . . . 0.0 111.82 -179.166 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.74 20.78 2.34 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.832 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.2 mt -137.21 105.1 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.877 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.927 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 9.1 tt -81.44 134.72 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 121.545 0.688 . . . . 0.0 110.26 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.794 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 57.7 mtt180 -128.44 -176.92 3.97 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.864 -1.516 . . . . 0.0 111.105 -177.597 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.556 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.8 m-85 -122.83 148.55 45.26 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.299 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.434 ' CE2' ' HD3' ' A' ' 7' ' ' PRO . 8.9 p90 -144.3 150.6 38.12 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.357 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.657 ' HE1' ' HA3' ' A' ' 26' ' ' GLY . 3.7 t80 -86.56 125.3 33.69 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -97.4 121.94 39.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.729 ' HB3' HD13 ' A' ' 4' ' ' LEU . . . -80.36 5.26 15.39 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.195 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -96.55 -16.57 21.0 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.873 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.931 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -128.09 -39.36 1.74 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.106 -179.368 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.657 ' HA3' ' HE1' ' A' ' 21' ' ' TYR . . . 114.12 -42.4 1.94 Allowed Glycine 0 C--N 1.343 0.934 0 C-N-CA 121.416 -0.421 . . . . 0.0 112.317 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.931 HD22 ' HB1' ' A' ' 25' ' ' ALA . 0.8 OUTLIER -77.1 169.6 18.04 Favored 'General case' 0 C--O 1.243 0.754 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -179.127 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 62.7 m -96.05 136.14 36.9 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.167 179.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.556 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 38.1 mt-30 -106.15 156.17 18.71 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 123.746 0.654 . . . . 0.0 111.652 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.513 HG23 ' CE1' ' A' ' 19' ' ' TYR . 47.8 p -92.26 129.44 38.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.398 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.467 ' C ' HG13 ' A' ' 17' ' ' ILE . 3.1 p90 -142.83 138.76 30.56 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.423 -0.808 . . . . 0.0 108.968 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.927 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 26.0 t -88.7 103.79 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 122.889 0.475 . . . . 0.0 111.74 -178.522 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -68.08 146.19 53.71 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.367 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -120.31 153.24 16.76 Favored Glycine 0 C--N 1.336 0.556 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.01 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -98.79 44.64 1.7 Allowed Glycine 0 C--N 1.336 0.575 0 C-N-CA 121.254 -0.498 . . . . 0.0 113.103 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.5 p -95.7 -36.18 11.29 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -128.17 -67.57 0.8 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 123.311 0.382 . . . . 0.0 111.394 -179.946 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 96.36 132.91 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.093 1.357 . . . . 0.0 110.056 -178.659 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -129.16 -112.17 0.27 Allowed 'General case' 0 CA--C 1.548 0.897 0 O-C-N 123.563 0.539 . . . . 0.0 111.772 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -151.67 -35.42 0.13 Allowed 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.504 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.3 OUTLIER -76.96 94.71 4.0 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.087 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.794 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 9.7 m120 -157.86 125.01 5.05 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.501 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.541 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 82.1 m-85 -132.51 101.54 5.36 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -65.51 -13.29 58.57 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.3 m -131.07 140.3 50.02 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.638 0.256 . . . . 0.0 111.271 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.74 -48.0 76.2 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.13 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -47.72 -59.16 3.5 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 124.008 0.818 . . . . 0.0 110.281 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -63.68 -36.74 84.86 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.625 0.37 . . . . 0.0 111.18 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.705 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 51.0 t -56.41 -60.48 3.46 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 123.594 0.558 . . . . 0.0 110.758 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.0 mtt -63.56 -36.89 85.3 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.5 ttt85 -67.39 -38.46 84.74 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 16.9 m -79.07 -49.72 12.21 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 122.879 0.112 . . . . 0.0 111.084 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.705 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -80.92 -58.59 3.02 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.653 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -86.92 45.44 3.43 Favored Glycine 0 C--N 1.346 1.107 0 C-N-CA 120.906 -0.664 . . . . 0.0 113.23 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -132.2 -69.3 0.09 OUTLIER Glycine 0 C--N 1.337 0.624 0 C-N-CA 121.487 -0.387 . . . . 0.0 112.508 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.129 179.997 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.503 0.192 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -123.64 -148.44 0.4 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.197 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.472 ' SG ' ' HB3' ' A' ' 21' ' ' TYR . 34.0 t 70.45 -14.06 0.43 Allowed 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 124.299 1.039 . . . . 0.0 112.638 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.456 HD11 ' CE2' ' A' ' 21' ' ' TYR . 19.1 tp -92.93 42.7 1.11 Allowed 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.533 0.682 . . . . 0.0 111.088 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.725 ' HB3' ' HZ2' ' A' ' 39' ' ' LYS . 61.1 mp0 -129.98 144.92 55.03 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.966 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -71.45 153.88 60.68 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 122.887 2.391 . . . . 0.0 112.804 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.41 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 36.4 Cg_endo -57.83 133.7 57.82 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 123.458 2.772 . . . . 0.0 113.265 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -105.17 13.27 30.92 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.01 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.508 HG23 ' O ' ' A' ' 12' ' ' CYS . 7.1 m -46.01 -24.15 0.39 Allowed 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.412 0.685 . . . . 0.0 112.702 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 53.47 -141.53 30.98 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-O 119.482 -0.621 . . . . 0.0 114.351 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.412 ' HD2' ' HE ' ' A' ' 37' ' ' ARG . 6.3 Cg_exo -79.25 -4.48 13.79 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 123.296 2.664 . . . . 0.0 113.218 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.508 ' O ' HG23 ' A' ' 9' ' ' THR . 0.1 OUTLIER -86.01 141.27 29.61 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 179.712 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.01 85.93 2.21 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.647 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.01 -167.51 1.03 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 114.569 -1.196 . . . . 0.0 111.498 -179.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.688 ' H ' ' HD3' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -119.43 34.34 5.26 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 121.178 0.513 . . . . 0.0 111.45 -179.073 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.3 mt -132.29 78.36 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.44 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 1.016 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.0 mp -65.28 145.9 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-O 121.454 0.645 . . . . 0.0 109.669 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.717 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 65.4 mtt180 -148.19 168.81 21.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.726 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.484 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.6 m-85 -112.85 148.4 34.98 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.585 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 4.8 p90 -141.49 152.77 44.47 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.449 1.093 . . . . 0.0 109.435 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.554 ' HE1' ' HA3' ' A' ' 26' ' ' GLY . 7.5 t80 -83.68 144.45 29.38 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -123.07 122.38 38.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.408 ' HB3' HD12 ' A' ' 4' ' ' LEU . . . -79.75 10.57 3.94 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.686 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -96.56 -22.25 17.18 Favored 'General case' 0 C--N 1.346 0.444 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.949 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -133.0 -11.6 2.93 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.075 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.554 ' HA3' ' HE1' ' A' ' 21' ' ' TYR . . . 86.8 -39.63 3.09 Favored Glycine 0 C--N 1.345 1.047 0 C-N-CA 121.555 -0.355 . . . . 0.0 113.291 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.949 HD22 ' HB1' ' A' ' 25' ' ' ALA . 0.4 OUTLIER -76.51 178.25 6.78 Favored 'General case' 0 C--O 1.244 0.8 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.429 ' H ' ' HE1' ' A' ' 50' ' ' MET . 89.3 m -102.27 151.01 22.73 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.985 -179.243 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.585 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 53.7 tp60 -116.45 158.62 23.26 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.716 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.414 HG21 ' CE1' ' A' ' 19' ' ' TYR . 39.9 p -94.0 126.49 39.25 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.791 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.514 ' O ' ' N ' ' A' ' 18' ' ' ARG . 2.7 p90 -145.18 140.29 27.82 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.055 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 1.016 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -89.08 101.26 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 C-N-CA 123.45 0.7 . . . . 0.0 112.526 -178.167 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.499 ' HH ' ' HA ' ' A' ' 38' ' ' ALA . 77.5 t80 -73.71 148.54 42.57 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.234 178.616 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -140.78 -172.97 13.23 Favored Glycine 0 C--N 1.338 0.641 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.34 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -94.5 1.58 66.68 Favored Glycine 0 C--N 1.34 0.767 0 O-C-N 123.767 0.334 . . . . 0.0 113.266 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -37.71 19.28 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.412 ' HE ' ' HD2' ' A' ' 11' ' ' PRO . 88.6 mtt-85 -137.05 111.85 8.82 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.936 0.398 . . . . 0.0 111.101 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.499 ' HA ' ' HH ' ' A' ' 33' ' ' TYR . . . -93.85 144.01 25.82 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.918 -179.933 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.725 ' HZ2' ' HB3' ' A' ' 5' ' ' GLU . 4.6 tmtp? -134.78 -128.04 0.16 Allowed 'General case' 0 CA--C 1.55 0.946 0 O-C-N 123.464 0.477 . . . . 0.0 110.744 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 78.2 mtm180 -144.28 -32.38 0.43 Allowed 'General case' 0 C--N 1.351 0.667 0 CA-C-N 118.185 0.448 . . . . 0.0 112.146 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -89.43 102.02 14.7 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.416 0.627 . . . . 0.0 111.363 -179.066 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.717 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 69.7 m-80 -144.64 116.92 8.46 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.862 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.546 ' HZ ' HG23 ' A' ' 52' ' ' THR . 70.3 m-85 -138.79 108.06 6.1 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.528 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -62.97 -16.81 60.9 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 60.0 p -130.98 136.68 48.76 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 120.731 0.3 . . . . 0.0 111.28 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -60.83 -43.12 98.69 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.444 179.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -48.6 -61.75 1.86 Allowed 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.857 0.723 . . . . 0.0 110.908 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -61.8 -38.24 87.38 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 122.433 0.293 . . . . 0.0 111.176 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.489 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 47.0 t -54.49 -60.04 3.88 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 123.653 0.596 . . . . 0.0 110.754 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.63 ' HB3' ' HA2' ' A' ' 55' ' ' GLY . 68.4 mtt -60.98 -40.5 93.69 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.061 0.545 . . . . 0.0 112.103 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -65.23 -30.72 71.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.546 HG23 ' HZ ' ' A' ' 43' ' ' PHE . 21.3 m -82.46 -50.3 9.01 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 122.921 0.138 . . . . 0.0 110.848 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -86.98 -58.98 2.39 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 150.08 100.91 0.22 Allowed Glycine 0 C--N 1.342 0.869 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.464 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . 0.63 ' HA2' ' HB3' ' A' ' 50' ' ' MET . . . -97.29 -48.1 2.08 Favored Glycine 0 C--N 1.337 0.623 0 C-N-CA 121.523 -0.37 . . . . 0.0 112.81 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.147 179.972 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 45.4 p30 . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 120.493 0.187 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -124.33 175.01 7.35 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.402 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.576 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 11.7 t 70.5 -15.67 0.35 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 124.48 1.112 . . . . 0.0 113.193 179.419 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.698 HD23 ' HE2' ' A' ' 21' ' ' TYR . 0.1 OUTLIER -79.5 -14.25 59.0 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.429 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -100.41 155.66 36.12 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.198 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.21 165.28 5.61 Favored 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 122.809 2.339 . . . . 0.0 112.827 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.544 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 28.9 Cg_endo -55.3 134.17 62.29 Favored 'Trans proline' 0 C--N 1.376 1.98 0 C-N-CA 123.318 2.679 . . . . 0.0 113.172 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.557 ' HD2' ' HB3' ' A' ' 39' ' ' LYS . 3.6 t80 -87.1 22.02 2.18 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 123.505 0.503 . . . . 0.0 112.057 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.81 HG22 HG13 ' A' ' 32' ' ' VAL . 20.2 m -50.17 -31.38 13.48 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.076 0.55 . . . . 0.0 111.287 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 37.87 -133.29 1.25 Allowed Glycine 0 C--N 1.352 1.454 0 O-C-N 124.126 0.891 . . . . 0.0 114.026 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -83.32 3.93 7.41 Favored 'Trans proline' 0 C--N 1.366 1.486 0 C-N-CA 123.062 2.508 . . . . 0.0 112.51 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.487 ' O ' HG21 ' A' ' 9' ' ' THR . 2.7 m -97.27 140.96 30.97 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.16 -179.653 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.727 ' HZ1' ' HB3' ' A' ' 13' ' ' LYS . 3.9 mmmp? -148.58 85.87 1.51 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.261 0.553 . . . . 0.0 110.444 -179.866 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.36 -171.4 2.93 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.999 179.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.19 35.82 3.13 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.158 0.504 . . . . 0.0 112.035 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.48 ' O ' HG21 ' A' ' 32' ' ' VAL . 17.4 mt -135.11 95.01 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.566 179.706 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 1.031 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.9 mp -93.87 138.86 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 121.74 0.781 . . . . 0.0 110.017 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.754 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 31.6 mtt180 -127.38 -153.19 0.55 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 113.497 -1.683 . . . . 0.0 109.546 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.624 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 3.4 m-85 -116.4 170.7 8.35 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.509 0.595 . . . . 0.0 112.262 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.633 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 9.3 p90 -159.52 167.76 27.82 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.571 1.169 . . . . 0.0 110.362 176.5 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.698 ' HE2' HD23 ' A' ' 4' ' ' LEU . 5.2 t80 -106.65 102.05 11.46 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.43 86.48 3.81 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.717 0.77 . . . . 0.0 109.095 178.616 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.551 ' HB3' ' CE2' ' A' ' 21' ' ' TYR . . . -71.12 0.73 7.03 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.605 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.8 ttpt -95.02 -34.15 12.45 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.32 -49.01 6.16 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.17 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 145.38 -57.76 0.52 Allowed Glycine 0 C--N 1.343 0.963 0 O-C-N 123.452 0.47 . . . . 0.0 112.853 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 pp -89.88 -175.4 4.59 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.3 m -99.59 136.76 39.05 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.666 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.633 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 20.9 tt0 -111.05 -151.29 0.48 Allowed 'General case' 0 C--O 1.243 0.744 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.612 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.624 ' HA ' ' HA ' ' A' ' 19' ' ' TYR . 34.1 p -138.69 135.35 34.72 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-N 118.789 0.722 . . . . 0.0 111.468 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.719 ' O ' ' N ' ' A' ' 18' ' ' ARG . 1.3 p90 -133.87 165.55 24.73 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.777 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 1.031 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.2 p -78.16 -163.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 C-N-CA 123.398 0.679 . . . . 0.0 111.533 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.421 ' H ' ' CG2' ' A' ' 32' ' ' VAL . 64.7 t80 -169.31 113.37 0.53 Allowed 'General case' 0 C--O 1.238 0.45 0 C-N-CA 124.145 0.978 . . . . 0.0 108.983 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -117.87 160.65 13.66 Favored Glycine 0 C--N 1.334 0.424 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.585 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -88.25 44.75 3.22 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 121.487 -0.387 . . . . 0.0 112.368 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.5 p -95.27 -49.15 5.6 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.478 0.311 . . . . 0.0 111.207 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -130.99 -37.34 1.29 Allowed 'General case' 0 N--CA 1.467 0.42 0 O-C-N 123.288 0.368 . . . . 0.0 111.485 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 53.86 113.65 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.123 0.969 . . . . 0.0 112.861 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.557 ' HB3' ' HD2' ' A' ' 8' ' ' TYR . 5.0 pttt -124.75 166.13 16.73 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.804 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -83.34 57.45 4.0 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.511 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.3 OUTLIER -148.58 92.82 2.05 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.664 178.632 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.754 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 9.1 m120 -156.9 143.97 18.69 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.2 178.498 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.478 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 31.3 m-85 -136.65 147.21 46.74 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -96.76 -43.38 7.55 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.576 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.6 m -127.46 158.63 36.86 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.44 -59.6 3.83 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.778 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -48.62 -39.96 25.93 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.317 0.647 . . . . 0.0 111.64 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -74.43 -34.87 63.34 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.997 178.228 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.473 ' HA ' ' CD2' ' A' ' 43' ' ' PHE . 45.2 t -67.75 -23.74 65.27 Favored 'General case' 0 C--N 1.349 0.556 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.692 177.728 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.582 ' HA ' ' HA2' ' A' ' 54' ' ' GLY . 94.3 mtp -83.71 -51.86 6.9 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -49.18 -38.47 25.95 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.057 179.058 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.403 ' HB ' ' CZ ' ' A' ' 43' ' ' PHE . 7.2 m -92.5 -49.78 5.95 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.187 178.666 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.594 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 1.6 p -128.34 65.25 1.4 Allowed 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.582 ' HA2' ' HA ' ' A' ' 50' ' ' MET . . . -168.9 73.88 0.13 Allowed Glycine 0 C--N 1.337 0.614 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.438 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.68 76.67 0.03 OUTLIER Glycine 0 C--N 1.338 0.641 0 C-N-CA 121.456 -0.402 . . . . 0.0 112.499 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.128 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.583 0.23 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -119.65 175.5 5.83 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.361 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.577 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 22.9 t 71.6 -37.31 0.39 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.647 1.179 . . . . 0.0 112.955 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 mp -82.71 -10.61 58.83 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -90.72 157.04 44.46 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.659 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -57.8 143.19 96.01 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.79 2.327 . . . . 0.0 113.181 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.52 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 39.8 Cg_endo -59.14 128.6 28.26 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 123.468 2.779 . . . . 0.0 113.824 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.652 ' HE2' ' HD3' ' A' ' 37' ' ' ARG . 81.4 t80 -129.6 100.93 5.7 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.738 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.451 HG21 ' N ' ' A' ' 34' ' ' GLY . 90.3 m -96.6 -79.65 0.45 Allowed 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.71 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.405 ' HA3' ' HD3' ' A' ' 11' ' ' PRO . . . 128.57 131.79 3.46 Favored Glycine 0 C--N 1.338 0.652 0 CA-C-O 118.83 -0.983 . . . . 0.0 110.666 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.405 ' HD3' ' HA3' ' A' ' 10' ' ' GLY . 15.1 Cg_exo -68.89 72.3 1.05 Allowed 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.704 2.27 . . . . 0.0 112.608 -179.141 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 51.2 m -126.02 -107.66 0.32 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.042 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -132.0 73.25 1.52 Allowed 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.444 0.64 . . . . 0.0 109.986 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.51 ' HB1' HG13 ' A' ' 32' ' ' VAL . . . -97.75 116.59 30.27 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.638 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -139.3 33.31 2.09 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.836 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.556 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 43.1 mt -138.46 121.35 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.362 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.623 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.1 mp -95.47 144.6 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.824 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 57.4 mtt180 -143.86 -174.74 4.34 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.492 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.587 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.1 m-85 -114.63 146.14 41.18 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.985 0.422 . . . . 0.0 112.051 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.599 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 4.0 p90 -139.76 153.96 47.28 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.023 -0.99 . . . . 0.0 108.731 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.525 ' HH ' ' HA3' ' A' ' 26' ' ' GLY . 63.0 t80 -98.74 135.18 40.59 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -101.09 139.65 36.47 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 176.205 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -96.19 2.87 53.4 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.811 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.6 tttm -99.1 -38.1 9.07 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.52 ' HB1' ' HG ' ' A' ' 27' ' ' LEU . . . -104.53 -25.46 12.76 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.879 -179.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.525 ' HA3' ' HH ' ' A' ' 21' ' ' TYR . . . 67.02 53.18 28.01 Favored Glycine 0 C--N 1.348 1.244 0 C-N-CA 121.341 -0.457 . . . . 0.0 112.637 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.52 ' HG ' ' HB1' ' A' ' 25' ' ' ALA . 3.3 pp -153.17 164.71 37.57 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 122.688 0.395 . . . . 0.0 111.012 -179.989 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.538 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 92.3 m -99.51 109.2 21.76 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.15 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.587 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -97.64 157.64 15.93 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.708 -178.852 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.509 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 34.6 p -87.78 130.09 34.97 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.517 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.599 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 7.5 p90 -152.36 152.64 32.32 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.214 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.623 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.1 t -77.44 161.38 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 C-N-CA 123.628 0.771 . . . . 0.0 112.545 -177.898 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.5 ' N ' ' O ' ' A' ' 16' ' ' ILE . 12.3 t80 -132.1 143.1 49.77 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.571 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.451 ' N ' HG21 ' A' ' 9' ' ' THR . . . -100.09 -161.1 28.47 Favored Glycine 0 C--N 1.337 0.597 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.113 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -144.06 3.26 1.47 Allowed Glycine 0 C--N 1.341 0.818 0 C-N-CA 121.139 -0.553 . . . . 0.0 114.094 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 25.7 p -84.24 -53.5 5.45 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.461 0.63 . . . . 0.0 110.534 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.652 ' HD3' ' HE2' ' A' ' 8' ' ' TYR . 54.7 ttt-85 -102.54 -84.54 0.45 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 177.583 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.428 ' HB3' ' CZ ' ' A' ' 33' ' ' TYR . . . 81.91 126.18 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.347 1.059 . . . . 0.0 112.173 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -112.36 -178.12 3.33 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.616 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 88.4 mtm180 -91.92 6.47 46.09 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.474 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.63 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.2 OUTLIER -96.5 76.51 2.9 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.032 0.444 . . . . 0.0 110.769 179.857 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.824 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 7.7 m120 -156.94 134.23 10.54 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.199 178.571 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.57 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 32.4 m-85 -134.24 105.5 6.67 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.293 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -73.27 -4.61 34.2 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.9 m -131.15 135.05 47.12 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 120.753 0.311 . . . . 0.0 111.512 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.52 -43.52 84.99 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.411 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -50.91 -56.19 13.54 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 123.667 0.605 . . . . 0.0 111.279 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -64.91 -48.93 72.39 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 116.682 -0.236 . . . . 0.0 110.443 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.568 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 43.1 t -48.02 -47.15 33.64 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 123.729 0.643 . . . . 0.0 111.336 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.19 -42.74 71.97 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.311 0.244 . . . . 0.0 111.405 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -69.5 -15.05 63.18 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.6 m -107.38 -51.88 2.85 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 122.952 0.158 . . . . 0.0 111.297 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.568 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.8 OUTLIER -111.11 18.33 19.5 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -178.967 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -111.05 -79.03 0.99 Allowed Glycine 0 C--N 1.34 0.798 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.478 178.681 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.1 98.56 0.96 Allowed Glycine 0 C--N 1.337 0.585 0 C-N-CA 121.474 -0.393 . . . . 0.0 112.479 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.299 -0.858 . . . . 0.0 111.054 -179.963 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.511 0.196 . . . . 0.0 111.158 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.538 ' CD2' ' HB3' ' A' ' 40' ' ' ARG . 3.7 p90 -111.18 149.27 31.17 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.125 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.5 t 175.35 -39.52 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.255 0.622 . . . . 0.0 110.864 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.638 HD12 ' HA ' ' A' ' 56' ' ' ALA . 6.1 mp -87.43 17.78 4.28 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 123.402 0.439 . . . . 0.0 111.862 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.441 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 5.8 mm-40 -96.16 122.52 57.81 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.077 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 2.8 Cg_exo -76.71 165.62 28.45 Favored 'Trans proline' 0 C--N 1.368 1.577 0 C-N-CA 123.062 2.508 . . . . 0.0 112.558 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.535 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 28.3 Cg_endo -55.08 135.63 69.63 Favored 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 123.372 2.715 . . . . 0.0 113.386 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.465 ' C ' ' H ' ' A' ' 10' ' ' GLY . 2.7 t80 -95.95 28.67 3.03 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.972 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.661 HG22 HG13 ' A' ' 32' ' ' VAL . 14.1 m -49.65 -4.86 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.465 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . -27.09 131.35 0.04 OUTLIER Glycine 0 N--CA 1.477 1.399 0 CA-C-O 118.219 -1.323 . . . . 0.0 112.42 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -16.91 77.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.076 1 C-N-CA 125.664 4.243 . . . . 0.0 116.013 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.6 m -134.09 176.52 8.51 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.358 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -87.27 55.44 3.54 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.891 0.853 . . . . 0.0 109.941 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.923 ' HB1' HG23 ' A' ' 32' ' ' VAL . . . -80.95 113.44 19.16 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.857 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.681 ' O ' HG13 ' A' ' 16' ' ' ILE . 5.8 tpm_? -133.71 33.33 3.49 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.723 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.681 HG13 ' O ' ' A' ' 15' ' ' ARG . 31.4 mt -154.94 113.83 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.43 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 1.089 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.8 mp -91.42 115.63 30.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 122.312 1.053 . . . . 0.0 109.902 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.734 ' N ' ' O ' ' A' ' 31' ' ' PHE . 2.2 mmp_? -100.8 -156.12 0.54 Allowed 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 112.428 -2.169 . . . . 0.0 110.081 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.499 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 4.8 m-85 -123.75 166.7 15.11 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.84 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 8.4 p90 -162.91 170.96 17.34 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.168 176.337 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.626 ' HB2' ' SG ' ' A' ' 49' ' ' CYS . 0.8 OUTLIER -115.74 107.91 15.67 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.479 0.312 . . . . 0.0 111.408 -178.852 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.548 ' C ' ' H ' ' A' ' 24' ' ' LYS . 65.5 m-80 -76.49 97.55 4.36 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-O 121.451 0.643 . . . . 0.0 112.064 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.456 ' CB ' ' HG ' ' A' ' 4' ' ' LEU . . . -76.62 24.07 0.15 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.881 177.912 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.548 ' H ' ' C ' ' A' ' 22' ' ' ASN . 12.7 tmtt? -98.73 -39.95 8.39 Favored 'General case' 0 C--N 1.35 0.624 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 177.466 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 -51.75 2.84 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.422 -1.263 . . . . 0.0 109.988 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.2 -35.18 1.59 Allowed Glycine 0 C--N 1.348 1.247 0 C-N-CA 121.246 -0.502 . . . . 0.0 112.972 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 pp -87.68 169.28 12.26 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.456 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 94.7 m -98.84 139.91 33.81 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.386 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.526 ' HB2' ' ND2' ' A' ' 22' ' ' ASN . 67.7 mt-30 -132.73 158.76 41.57 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 123.466 0.479 . . . . 0.0 110.98 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.499 ' HA ' ' HA ' ' A' ' 19' ' ' TYR . 45.1 p -85.65 121.44 28.33 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.412 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.734 ' O ' ' N ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -113.54 178.81 4.15 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 176.682 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 1.089 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.3 p -91.4 -159.16 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 118.794 0.724 . . . . 0.0 110.897 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.467 ' H ' ' CG2' ' A' ' 32' ' ' VAL . 77.2 t80 -173.49 111.34 0.19 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.514 1.125 . . . . 0.0 108.564 177.914 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.641 ' HA3' ' HA ' ' A' ' 14' ' ' ALA . . . -92.59 163.26 27.2 Favored Glycine 0 C--N 1.336 0.571 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.743 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.31 26.42 11.83 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 121.372 -0.442 . . . . 0.0 113.133 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -95.59 -51.02 4.71 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 122.185 0.194 . . . . 0.0 111.072 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 -145.18 139.8 27.49 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.317 0.385 . . . . 0.0 111.441 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -99.69 118.63 36.61 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.769 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.76 -171.46 2.06 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.236 0.541 . . . . 0.0 111.078 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.538 ' HB3' ' CD2' ' A' ' 2' ' ' PHE . 40.1 mmt180 -82.38 -74.5 0.34 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.428 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.459 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.3 OUTLIER -51.71 101.94 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.966 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -148.67 136.19 20.46 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 114.022 -1.445 . . . . 0.0 109.311 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.84 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 59.4 m-85 -138.17 150.07 46.44 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.565 ' HG3' ' NH1' ' A' ' 18' ' ' ARG . 0.7 OUTLIER -97.23 -46.02 6.29 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 114.684 -1.144 . . . . 0.0 111.922 -179.594 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.492 ' HB2' ' OD2' ' A' ' 48' ' ' ASP . 52.9 m -133.3 168.09 19.21 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.199 0.312 . . . . 0.0 111.603 -179.174 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.424 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -63.25 -64.69 0.83 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.875 0.47 . . . . 0.0 111.814 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.479 ' O ' ' HD2' ' A' ' 51' ' ' ARG . 97.9 mt-10 -53.17 -34.75 58.23 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.809 0.444 . . . . 0.0 111.836 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.492 ' OD2' ' HB2' ' A' ' 45' ' ' SER . 54.8 m-20 -73.52 -33.32 64.7 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.269 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.653 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 33.9 t -63.84 -47.55 80.32 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.914 178.454 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 74.7 mtm -69.6 -48.22 60.87 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.478 179.427 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.479 ' HD2' ' O ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -64.17 -30.41 71.47 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 31.0 m -90.69 -32.0 16.36 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.48 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.55 ' HB3' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -80.85 -51.95 8.03 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 117.856 0.298 . . . . 0.0 111.008 -179.782 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 97.61 -51.54 1.36 Allowed Glycine 0 C--N 1.344 0.983 0 C-N-CA 121.358 -0.449 . . . . 0.0 112.61 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.9 95.46 2.4 Favored Glycine 0 C--N 1.336 0.568 0 C-N-CA 121.389 -0.434 . . . . 0.0 112.535 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . 0.638 ' HA ' HD12 ' A' ' 4' ' ' LEU . . . . . . . . 0 N--CA 1.483 1.194 0 C-N-CA 124.058 0.943 . . . . 0.0 112.348 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.598 0.237 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -138.52 -32.22 0.71 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.397 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.9 t -77.25 -20.3 55.37 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.855 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.0 pp -88.05 23.78 2.0 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 120.952 0.406 . . . . 0.0 111.874 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -96.01 155.31 38.42 Favored Pre-proline 0 CA--C 1.537 0.447 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.784 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.3 141.45 81.94 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.675 2.25 . . . . 0.0 113.452 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.493 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 29.1 Cg_endo -54.81 133.87 59.86 Favored 'Trans proline' 0 C--N 1.372 1.766 0 C-N-CA 123.968 3.112 . . . . 0.0 114.029 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.438 ' HH ' ' HE ' ' A' ' 37' ' ' ARG . 84.8 t80 -135.54 103.53 5.49 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.592 -179.73 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.584 HG21 ' HA ' ' A' ' 33' ' ' TYR . 28.5 m -96.49 -78.06 0.47 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.26 146.81 9.38 Favored Glycine 0 C--N 1.342 0.898 0 CA-C-O 119.117 -0.824 . . . . 0.0 111.636 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.469 ' HD2' HH22 ' A' ' 37' ' ' ARG . 7.9 Cg_exo -72.35 68.9 3.4 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.882 2.388 . . . . 0.0 112.247 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.9 m -124.9 -152.8 0.53 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.827 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -87.25 57.65 4.58 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.834 0.826 . . . . 0.0 110.182 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.628 ' HA ' ' HA3' ' A' ' 34' ' ' GLY . . . -85.26 116.17 23.45 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.697 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.498 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 3.4 ppt_? -142.16 21.77 2.08 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.046 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.5 mt -131.96 116.05 29.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.223 -178.974 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.865 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.7 mp -92.83 106.68 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 122.267 1.032 . . . . 0.0 109.355 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.617 ' N ' ' O ' ' A' ' 31' ' ' PHE . 51.2 mtt180 -98.2 174.58 6.44 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 112.825 -1.989 . . . . 0.0 110.955 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.525 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 1.5 m-85 -110.73 152.11 26.96 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.625 0.25 . . . . 0.0 111.093 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.573 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 2.4 p90 -139.83 157.46 45.68 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.579 ' CZ ' ' HA3' ' A' ' 26' ' ' GLY . 80.9 t80 -90.71 129.83 36.76 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.734 0.302 . . . . 0.0 111.366 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.61 ' HB2' HD12 ' A' ' 27' ' ' LEU . 3.2 m120 -96.58 127.66 42.77 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.31 11.79 20.24 Favored 'General case' 0 C--O 1.239 0.526 0 O-C-N 123.416 0.447 . . . . 0.0 111.981 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.703 ' HZ1' ' HB3' ' A' ' 24' ' ' LYS . 9.0 mtpm? -97.42 -25.04 15.34 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.651 0.262 . . . . 0.0 110.916 179.304 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.403 ' CB ' HD11 ' A' ' 27' ' ' LEU . . . -138.38 -27.37 0.87 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.731 -178.719 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.579 ' HA3' ' CZ ' ' A' ' 21' ' ' TYR . . . 99.09 8.66 53.45 Favored Glycine 0 C--N 1.344 1.009 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.944 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.61 HD12 ' HB2' ' A' ' 22' ' ' ASN . 0.0 OUTLIER -96.51 151.21 19.79 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.581 0.229 . . . . 0.0 111.344 -179.634 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.449 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 87.3 m -93.56 110.26 21.85 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.36 178.733 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.573 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 33.1 tt0 -88.0 159.14 18.42 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.048 -177.549 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.435 HG23 ' CE1' ' A' ' 19' ' ' TYR . 35.5 p -96.32 128.69 43.48 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.442 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.617 ' O ' ' N ' ' A' ' 18' ' ' ARG . 7.7 p90 -152.2 152.22 31.97 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.643 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.865 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -78.33 174.28 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 C-N-CA 123.491 0.717 . . . . 0.0 111.982 -177.824 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.584 ' HA ' HG21 ' A' ' 9' ' ' THR . 48.0 t80 -155.99 139.5 15.89 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.352 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.628 ' HA3' ' HA ' ' A' ' 14' ' ' ALA . . . -102.59 -55.0 0.85 Allowed Glycine 0 C--N 1.338 0.685 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.187 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 98.36 27.37 8.7 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.527 -0.368 . . . . 0.0 113.319 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.6 p -95.79 -43.07 8.03 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.28 0.232 . . . . 0.0 111.545 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.469 HH22 ' HD2' ' A' ' 11' ' ' PRO . 84.4 mtm-85 -116.03 8.87 14.68 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 123.357 0.411 . . . . 0.0 111.644 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 12.2 118.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -92.7 -124.69 0.09 Allowed 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.721 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -140.46 -34.74 0.52 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 118.35 0.523 . . . . 0.0 111.47 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.449 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.4 OUTLIER -83.81 96.92 8.91 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.004 0.43 . . . . 0.0 111.789 -179.062 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.571 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 8.7 m120 -154.92 118.48 4.53 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.271 177.803 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.525 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 28.8 m-85 -137.96 105.69 5.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.726 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -76.36 2.45 13.45 Favored 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.5 m -135.77 132.12 36.37 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.222 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.69 -45.48 89.84 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.392 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -48.39 -55.25 11.28 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.426 0.69 . . . . 0.0 111.516 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -66.15 -45.63 80.32 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 122.449 0.3 . . . . 0.0 110.749 178.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.425 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 44.7 t -47.06 -50.38 19.75 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 123.803 0.689 . . . . 0.0 111.393 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 94.9 mtp -77.38 -35.72 54.14 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.638 0.375 . . . . 0.0 111.973 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -62.47 -28.69 69.99 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 9.8 m -104.09 -52.19 2.99 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 123.196 0.31 . . . . 0.0 110.944 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.425 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -99.45 19.71 15.12 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.31 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.34 75.84 0.31 Allowed Glycine 0 C--N 1.342 0.874 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.433 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -91.59 -54.55 1.92 Allowed Glycine 0 C--N 1.337 0.607 0 C-N-CA 121.554 -0.355 . . . . 0.0 112.772 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.332 -0.842 . . . . 0.0 111.196 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.931 ' H1 ' HH22 ' A' ' 40' ' ' ARG . 47.1 t0 . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.521 0.2 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.418 ' HD1' ' SG ' ' A' ' 3' ' ' CYS . 12.3 p90 -130.94 -171.19 2.51 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.936 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.464 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 67.8 m 72.54 -51.56 0.7 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.379 1.071 . . . . 0.0 112.698 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 57.6 mt -79.35 -11.96 59.93 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -95.04 146.49 31.41 Favored Pre-proline 0 CA--C 1.535 0.398 0 O-C-N 123.18 0.3 . . . . 0.0 110.388 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.17 163.0 30.59 Favored 'Trans proline' 0 C--N 1.369 1.631 0 C-N-CA 122.804 2.336 . . . . 0.0 112.725 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.52 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 55.4 Cg_endo -62.44 153.11 73.13 Favored 'Trans proline' 0 C--N 1.373 1.823 0 C-N-CA 123.009 2.473 . . . . 0.0 112.448 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.717 ' HE2' ' HD3' ' A' ' 37' ' ' ARG . 2.0 t80 -88.31 22.15 2.59 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.787 HG22 HG13 ' A' ' 32' ' ' VAL . 7.1 m -55.6 -5.86 0.16 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.94 0.496 . . . . 0.0 111.789 178.973 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.46 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . -28.7 -90.52 0.01 OUTLIER Glycine 0 C--N 1.352 1.472 0 C-N-CA 124.253 0.93 . . . . 0.0 114.446 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -89.58 14.37 2.18 Favored 'Trans proline' 0 C--N 1.362 1.273 0 C-N-CA 122.933 2.422 . . . . 0.0 113.38 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.443 ' O ' HG21 ' A' ' 9' ' ' THR . 3.1 m -137.97 122.49 18.46 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 120.603 0.24 . . . . 0.0 110.883 -179.324 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.548 ' HG3' HG21 ' A' ' 9' ' ' THR . 0.3 OUTLIER -141.53 82.66 1.83 Allowed 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.865 179.725 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.86 -170.83 2.68 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.175 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.65 38.09 1.88 Allowed 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.041 0.448 . . . . 0.0 112.133 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.548 ' O ' HG21 ' A' ' 32' ' ' VAL . 20.5 mt -129.96 102.02 6.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.482 -179.852 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.911 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 44.9 mm -91.26 144.29 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.772 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.8 ' N ' ' O ' ' A' ' 31' ' ' PHE . 4.0 ttt180 -134.8 -154.78 0.61 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.657 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.494 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 10.6 m-85 -120.33 156.36 31.47 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.292 0.496 . . . . 0.0 111.73 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.583 ' HD1' ' O ' ' A' ' 29' ' ' GLN . 0.1 OUTLIER -164.75 179.91 6.27 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 114.838 -1.073 . . . . 0.0 112.131 177.716 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.435 ' HB3' ' O ' ' A' ' 3' ' ' CYS . 63.6 t80 -94.76 168.74 10.63 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -142.95 123.54 14.05 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 120.056 1.298 . . . . 0.0 109.953 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.63 12.99 6.13 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.603 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.666 ' HB2' ' HZ1' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -98.35 -39.04 9.0 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-O 121.035 0.445 . . . . 0.0 110.477 178.789 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.875 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -112.06 -35.65 5.6 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.388 -179.638 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.06 -39.4 2.68 Favored Glycine 0 C--N 1.341 0.85 0 O-C-N 123.48 0.488 . . . . 0.0 112.615 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.875 HD22 ' HB2' ' A' ' 25' ' ' ALA . 1.2 pt? -82.59 -163.83 0.76 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.886 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 98.3 m -111.0 144.91 39.36 Favored 'General case' 0 C--N 1.347 0.469 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.357 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.583 ' O ' ' HD1' ' A' ' 20' ' ' PHE . 3.2 tp-100 -144.44 169.24 18.31 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.611 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.8 p -87.09 126.94 35.09 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -178.115 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.8 ' O ' ' N ' ' A' ' 18' ' ' ARG . 1.8 p90 -122.64 170.93 9.53 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.247 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.911 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.5 p -76.14 -161.74 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 C-N-CA 123.449 0.699 . . . . 0.0 111.35 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.455 ' H ' ' CG2' ' A' ' 32' ' ' VAL . 71.2 t80 179.39 117.78 0.05 OUTLIER 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.681 1.192 . . . . 0.0 108.947 178.692 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -115.53 148.51 18.91 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.34 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -86.13 46.97 3.69 Favored Glycine 0 C--N 1.34 0.755 0 C-N-CA 121.499 -0.381 . . . . 0.0 112.33 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.7 p -95.19 -46.25 6.85 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.873 0.396 . . . . 0.0 111.34 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.717 ' HD3' ' HE2' ' A' ' 8' ' ' TYR . 53.9 ttt-85 -137.9 -36.97 0.6 Allowed 'General case' 0 CA--C 1.536 0.424 0 O-C-N 123.372 0.42 . . . . 0.0 111.216 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 63.47 116.03 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.59 0.756 . . . . 0.0 111.725 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.5 mmtt -105.46 -163.67 0.96 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.423 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.931 HH22 ' H1 ' ' A' ' 1' ' ' ASP . 89.1 mtm180 -82.38 -76.08 0.28 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.46 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.443 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.4 OUTLIER -39.65 99.2 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -177.817 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -148.8 129.02 13.69 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 114.254 -1.339 . . . . 0.0 110.155 177.643 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.494 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 84.4 m-85 -134.19 148.02 50.84 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -98.47 -41.31 7.84 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.671 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.4 m -132.32 163.56 28.38 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.75 -55.51 29.41 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.194 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.47 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 60.4 mp0 -52.18 -28.63 18.96 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -80.38 -39.1 29.07 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.449 ' HA ' ' CE1' ' A' ' 43' ' ' PHE . 36.3 t -67.01 -24.06 65.98 Favored 'General case' 0 C--N 1.35 0.622 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.661 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.462 ' O ' ' N ' ' A' ' 54' ' ' GLY . 94.8 mtp -81.29 -55.99 4.36 Favored 'General case' 0 C--N 1.348 0.541 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.974 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.47 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 99.3 mtt180 -45.66 -37.4 5.69 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.823 0.449 . . . . 0.0 111.483 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.8 m -90.28 -58.53 2.47 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 123.483 0.489 . . . . 0.0 110.044 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.464 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -121.34 62.46 0.9 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.635 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.462 ' N ' ' O ' ' A' ' 50' ' ' MET . . . -96.92 -100.37 1.98 Allowed Glycine 0 C--N 1.336 0.537 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.574 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -140.0 48.66 0.83 Allowed Glycine 0 C--N 1.338 0.651 0 C-N-CA 121.378 -0.439 . . . . 0.0 112.65 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.265 0 C-N-CA 124.01 0.924 . . . . 0.0 112.341 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.556 0.217 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.437 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 3.0 p90 -118.66 -158.96 0.74 Allowed 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.115 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.439 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 56.0 m 73.03 -51.26 0.71 Allowed 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.346 1.058 . . . . 0.0 111.891 -179.362 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.62 HD11 ' HB3' ' A' ' 23' ' ' ALA . 4.4 mm? -80.11 -2.2 43.47 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.727 0.411 . . . . 0.0 111.892 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -94.1 155.21 40.31 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.721 179.444 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -67.02 148.56 81.86 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.826 2.351 . . . . 0.0 112.945 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.523 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 38.3 Cg_endo -58.97 138.62 86.69 Favored 'Trans proline' 0 C--N 1.371 1.739 0 C-N-CA 123.624 2.882 . . . . 0.0 113.884 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.535 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 32.0 t80 -128.78 95.51 4.12 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.238 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.2 m -95.22 -70.8 0.7 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.563 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.2 160.23 23.39 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-O 119.288 -0.729 . . . . 0.0 112.141 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.533 ' HA ' ' HZ1' ' A' ' 13' ' ' LYS . 3.0 Cg_exo -74.99 64.21 6.03 Favored 'Trans proline' 0 C--N 1.369 1.644 0 C-N-CA 122.937 2.424 . . . . 0.0 112.753 -179.7 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.6 m -132.0 -65.25 0.75 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.756 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.533 ' HZ1' ' HA ' ' A' ' 11' ' ' PRO . 11.5 mptt 53.07 87.1 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.078 0.951 . . . . 0.0 112.342 179.405 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.514 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -87.28 48.92 1.72 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.255 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.514 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.2 OUTLIER 43.05 36.55 0.95 Allowed 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 178.87 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.476 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 38.1 mt -132.35 141.64 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.966 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.788 HG13 HG21 ' A' ' 32' ' ' VAL . 5.0 mp -117.85 103.33 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 122.159 0.981 . . . . 0.0 108.513 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.607 ' N ' ' O ' ' A' ' 31' ' ' PHE . 19.2 mtt180 -90.77 -169.04 2.24 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 113.106 -1.861 . . . . 0.0 111.404 -179.346 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.417 ' CE2' ' HB3' ' A' ' 46' ' ' ALA . 10.6 m-85 -124.84 158.96 32.16 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 122.334 0.254 . . . . 0.0 110.898 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.544 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 7.6 p90 -157.48 169.13 25.41 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 177.847 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.727 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 64.6 t80 -94.74 116.51 28.83 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.797 0.332 . . . . 0.0 110.955 179.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.568 HD22 ' HB2' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -98.69 83.68 3.01 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.542 179.443 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.62 ' HB3' HD11 ' A' ' 4' ' ' LEU . . . -55.68 -3.31 0.07 Allowed 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -179.082 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.451 ' H ' ' C ' ' A' ' 22' ' ' ASN . 79.9 tttt -96.48 -29.73 13.74 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.447 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.455 ' HB1' ' HB2' ' A' ' 22' ' ' ASN . . . -89.96 -33.4 16.4 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.85 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.21 -15.9 15.4 Favored Glycine 0 C--N 1.344 0.984 0 C-N-CA 121.055 -0.593 . . . . 0.0 114.274 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 pp -154.26 -169.71 3.32 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 117.436 0.618 . . . . 0.0 111.737 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.544 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 58.8 m -81.7 139.82 34.68 Favored 'General case' 0 C--N 1.35 0.614 0 C-N-CA 122.867 0.467 . . . . 0.0 111.088 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.568 ' HB2' HD22 ' A' ' 22' ' ' ASN . 70.1 mt-30 -131.45 157.74 42.68 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.47 0.652 . . . . 0.0 112.653 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -77.81 130.14 36.32 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 113.382 -1.735 . . . . 0.0 111.766 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.607 ' O ' ' N ' ' A' ' 18' ' ' ARG . 5.9 p90 -150.93 151.59 32.37 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.299 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.788 HG21 HG13 ' A' ' 17' ' ' ILE . 20.7 t -76.59 125.19 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.833 0.853 . . . . 0.0 110.922 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.548 ' CG ' ' HD2' ' A' ' 18' ' ' ARG . 51.8 t80 -103.32 155.27 18.59 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.995 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.449 ' HA3' ' H ' ' A' ' 14' ' ' ALA . . . -105.8 -58.62 0.63 Allowed Glycine 0 C--N 1.336 0.566 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.496 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 87.33 17.95 58.05 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 121.473 -0.394 . . . . 0.0 113.004 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 25.5 p -95.05 -38.39 10.66 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 122.565 0.346 . . . . 0.0 111.245 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.471 ' HD3' ' HH ' ' A' ' 8' ' ' TYR . 59.9 ttt180 -126.92 29.68 5.6 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 123.411 0.444 . . . . 0.0 110.581 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.508 ' HB3' ' OH ' ' A' ' 33' ' ' TYR . . . -18.61 130.66 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -179.54 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.535 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 17.3 tptm -108.32 -132.57 0.32 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.424 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -123.35 -54.61 1.78 Allowed 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.584 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.2 OUTLIER -66.54 80.22 0.1 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.247 0.546 . . . . 0.0 111.372 -179.47 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.468 ' ND2' ' HZ ' ' A' ' 31' ' ' PHE . 10.2 m120 -157.69 142.88 16.9 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.238 178.536 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -133.41 154.18 50.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.963 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -97.65 -46.94 5.81 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.04 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.7 t -112.95 150.48 31.79 Favored 'General case' 0 C--O 1.241 0.625 0 O-C-N 123.486 0.492 . . . . 0.0 111.509 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.417 ' HB3' ' CE2' ' A' ' 19' ' ' TYR . . . -68.04 -38.19 82.21 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.819 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.415 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 67.4 tt0 -57.25 -42.94 82.48 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 123.499 0.499 . . . . 0.0 110.998 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -70.6 -54.74 10.85 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.203 178.651 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 14.1 t -54.64 -29.69 53.05 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.463 0.477 . . . . 0.0 111.992 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.519 ' HA ' ' HA2' ' A' ' 54' ' ' GLY . 53.0 mtt -77.9 -47.96 17.48 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 122.819 0.448 . . . . 0.0 111.105 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.415 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 99.4 mtt180 -59.82 -30.88 69.23 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.398 0.436 . . . . 0.0 111.675 179.198 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.7 m -89.24 -55.81 3.52 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.727 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 2.7 p -138.98 68.58 1.38 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.015 0.436 . . . . 0.0 111.593 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.519 ' HA2' ' HA ' ' A' ' 50' ' ' MET . . . -118.16 55.61 0.58 Allowed Glycine 0 C--N 1.339 0.727 0 C-N-CA 121.086 -0.578 . . . . 0.0 112.466 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.15 -39.52 2.44 Favored Glycine 0 C--N 1.337 0.604 0 C-N-CA 121.332 -0.461 . . . . 0.0 112.931 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.118 179.995 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 120.519 0.199 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.836 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 6.5 p90 -95.78 5.87 50.28 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.977 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.6 t -86.16 -11.26 53.04 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.797 0.439 . . . . 0.0 111.289 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.557 ' HA ' ' HB3' ' A' ' 23' ' ' ALA . 50.9 mt -125.08 -4.01 7.5 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.821 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -93.77 146.92 32.63 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.464 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -78.76 162.81 26.75 Favored 'Trans proline' 0 C--N 1.371 1.739 0 C-N-CA 123.327 2.685 . . . . 0.0 112.915 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.633 ' HD3' ' HE2' ' A' ' 20' ' ' PHE . 66.8 Cg_endo -66.35 159.75 48.68 Favored 'Trans proline' 0 C--N 1.374 1.895 0 C-N-CA 123.202 2.601 . . . . 0.0 113.727 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.472 ' HB3' ' HG2' ' A' ' 39' ' ' LYS . 54.0 t80 -137.17 83.85 2.02 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.573 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.6 m -95.86 -55.88 2.85 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.232 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.89 -159.07 29.97 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 119.303 -0.721 . . . . 0.0 112.731 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -75.48 -1.1 10.9 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 123.017 2.478 . . . . 0.0 113.058 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.13 142.9 26.99 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.634 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -140.32 89.85 2.32 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.7 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.402 ' O ' HG12 ' A' ' 32' ' ' VAL . . . -78.03 176.1 9.48 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.824 -179.171 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.491 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 0.1 OUTLIER -105.1 25.98 9.88 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.16 0.505 . . . . 0.0 111.823 -179.045 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.485 ' C ' HG11 ' A' ' 32' ' ' VAL . 12.2 mt -127.66 86.76 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.571 -179.065 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.99 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.6 mp -82.74 145.0 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.423 0.63 . . . . 0.0 109.798 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.508 ' N ' ' O ' ' A' ' 31' ' ' PHE . 5.8 ttm-85 -139.6 -161.46 1.19 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.22 -1.355 . . . . 0.0 110.395 -177.704 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 3.9 m-85 -119.24 165.6 14.03 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 120.626 0.25 . . . . 0.0 111.52 -179.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.633 ' HE2' ' HD3' ' A' ' 7' ' ' PRO . 1.6 p90 -166.08 -178.27 4.57 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.397 176.556 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.533 ' HE2' ' SD ' ' A' ' 50' ' ' MET . 34.7 t80 -125.27 130.12 51.41 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -106.52 125.46 51.03 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 120.621 0.248 . . . . 0.0 110.983 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . 0.557 ' HB3' ' HA ' ' A' ' 4' ' ' LEU . . . -82.42 15.27 2.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.208 178.633 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.3 tptp -97.18 -39.92 9.05 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.503 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.532 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -102.62 -32.46 9.88 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.999 179.684 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 97.18 9.58 55.51 Favored Glycine 0 C--N 1.34 0.797 0 CA-C-N 115.904 -0.589 . . . . 0.0 114.088 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.862 ' HG ' HE22 ' A' ' 29' ' ' GLN . 0.6 OUTLIER -132.93 173.89 10.92 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 117.292 0.546 . . . . 0.0 111.479 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.504 ' SG ' ' HD2' ' A' ' 21' ' ' TYR . 72.8 m -90.2 133.64 34.78 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.775 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.862 HE22 ' HG ' ' A' ' 27' ' ' LEU . 12.6 mp0 -112.92 -162.36 0.8 Allowed 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.706 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 41.3 p -131.26 126.75 36.25 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.242 0.617 . . . . 0.0 109.741 178.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.533 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 2.5 p90 -145.19 149.18 34.49 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.586 -178.78 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.99 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -73.89 179.9 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 124.462 1.105 . . . . 0.0 112.251 -176.885 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.592 ' OH ' ' HB3' ' A' ' 38' ' ' ALA . 50.8 t80 -158.54 135.24 9.57 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.784 0.834 . . . . 0.0 109.334 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.3 -174.27 14.18 Favored Glycine 0 C--N 1.336 0.529 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.838 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -89.56 8.51 79.68 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 121.535 -0.364 . . . . 0.0 113.029 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.11 -52.07 4.37 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 122.724 0.409 . . . . 0.0 111.88 179.758 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 1.3 mpt_? -132.24 110.48 10.65 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.05 0.452 . . . . 0.0 111.321 179.381 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.592 ' HB3' ' OH ' ' A' ' 33' ' ' TYR . . . -101.08 140.92 34.71 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.801 -179.988 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.472 ' HG2' ' HB3' ' A' ' 8' ' ' TYR . 6.9 mmtt -115.02 -162.18 0.81 Allowed 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.46 0.475 . . . . 0.0 110.777 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.2 mmt180 -125.16 3.54 7.89 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.863 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.836 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -119.55 100.39 7.25 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.03 0.443 . . . . 0.0 110.162 179.104 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -134.68 132.2 38.62 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.824 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.491 ' CD1' ' HA ' ' A' ' 49' ' ' CYS . 55.0 m-85 -142.53 164.72 29.36 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.004 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -99.54 -44.84 6.01 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.166 0.186 . . . . 0.0 110.89 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -136.4 161.41 35.89 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.652 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.72 -25.72 67.61 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.647 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -59.72 -70.6 0.16 Allowed 'General case' 0 N--CA 1.474 0.742 0 O-C-N 123.413 0.445 . . . . 0.0 109.849 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -58.98 -40.16 84.0 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 122.88 0.472 . . . . 0.0 110.46 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.491 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 49.7 t -52.58 -58.16 7.69 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.758 0.661 . . . . 0.0 111.559 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.831 ' HE3' ' HA ' ' A' ' 27' ' ' LEU . 5.5 mmt -64.54 -42.24 95.85 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.7 tpp85 -70.25 -24.95 63.16 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.2 m -90.46 -40.63 11.91 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 122.995 0.185 . . . . 0.0 111.392 -179.627 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.9 -55.09 4.0 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -98.75 51.37 1.19 Allowed Glycine 0 C--N 1.342 0.902 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.625 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -164.9 63.18 0.23 Allowed Glycine 0 C--N 1.338 0.641 0 C-N-CA 121.485 -0.388 . . . . 0.0 112.504 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.061 -179.962 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.497 0.189 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.536 ' HD1' ' H ' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -130.84 -20.08 2.86 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.848 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.495 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 18.7 m -71.21 -42.76 68.56 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 122.832 0.453 . . . . 0.0 112.14 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.3 mp -79.86 -7.89 58.98 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.172 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -92.74 153.32 42.24 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.939 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -64.08 139.66 68.09 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 122.705 2.27 . . . . 0.0 113.282 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.632 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 37.6 Cg_endo -58.43 136.46 74.46 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 123.555 2.836 . . . . 0.0 114.197 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -99.45 89.12 4.07 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.217 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.5 m -96.43 -63.37 1.15 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.458 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.571 ' HA2' ' HD2' ' A' ' 37' ' ' ARG . . . 84.76 -174.93 50.29 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 119.251 -0.749 . . . . 0.0 112.338 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.509 ' HD2' ' HE ' ' A' ' 37' ' ' ARG . 3.4 Cg_exo -76.95 17.88 0.8 Allowed 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.946 2.431 . . . . 0.0 113.141 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.74 132.48 56.15 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.651 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.424 ' CB ' HG13 ' A' ' 32' ' ' VAL . 10.1 mptt -139.02 86.21 2.12 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.243 -179.942 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.487 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -80.32 52.99 1.69 Allowed 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.973 -1.012 . . . . 0.0 112.456 -179.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.487 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.4 OUTLIER 42.13 36.2 0.67 Allowed 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 178.903 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.607 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 37.6 mt -136.46 121.6 26.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-N 116.264 -0.426 . . . . 0.0 109.86 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.541 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.4 mp -121.91 106.36 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 122.177 0.989 . . . . 0.0 108.799 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.64 ' N ' ' O ' ' A' ' 31' ' ' PHE . 33.0 mtp180 -81.88 -160.07 0.33 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 113.227 -1.806 . . . . 0.0 111.178 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.528 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 15.7 m-85 -129.81 113.5 14.77 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.907 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.563 ' HB3' ' CD1' ' A' ' 31' ' ' PHE . 4.8 p90 -106.87 -174.59 2.57 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.644 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -128.42 134.72 48.85 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.326 0.107 . . . . 0.0 110.924 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -106.57 107.4 18.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.29 -2.73 6.43 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -96.38 -34.4 11.56 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.598 0.237 . . . . 0.0 110.588 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -92.18 -41.76 10.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.0 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.08 52.04 2.66 Favored Glycine 0 C--N 1.342 0.865 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 pp -166.35 162.14 16.96 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 123.108 0.563 . . . . 0.0 111.159 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 m -94.91 111.49 23.28 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.746 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.544 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 16.8 tp60 -87.73 -163.74 0.99 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.461 -179.065 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.536 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 33.6 p -129.4 133.37 47.33 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.162 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.64 ' O ' ' N ' ' A' ' 18' ' ' ARG . 14.3 p90 -133.97 148.24 51.13 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.893 0.378 . . . . 0.0 111.569 -178.192 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.607 ' HA ' ' O ' ' A' ' 16' ' ' ILE . 10.9 t -77.06 125.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 123.933 0.893 . . . . 0.0 111.791 -178.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.616 ' HE1' ' H ' ' A' ' 39' ' ' LYS . 77.5 t80 -126.53 129.16 48.08 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.108 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.418 ' HA3' ' HB3' ' A' ' 14' ' ' ALA . . . -128.04 -170.82 12.89 Favored Glycine 0 C--N 1.336 0.547 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.274 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -87.98 -9.64 70.55 Favored Glycine 0 C--N 1.341 0.811 0 O-C-N 123.735 0.314 . . . . 0.0 112.947 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.72 -34.67 27.18 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.789 0.436 . . . . 0.0 112.143 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.571 ' HD2' ' HA2' ' A' ' 10' ' ' GLY . 84.0 mtt-85 -129.58 83.87 2.17 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.504 0.668 . . . . 0.0 110.383 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -93.09 117.63 30.29 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.511 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.616 ' H ' ' HE1' ' A' ' 33' ' ' TYR . 7.4 mmtt -147.06 -174.83 4.6 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.567 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -109.75 90.2 3.24 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.632 ' ND2' ' HA ' ' A' ' 7' ' ' PRO . 0.6 OUTLIER -87.27 -68.63 0.74 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.802 -178.265 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.558 ' CB ' ' HA ' ' A' ' 20' ' ' PHE . 9.1 t-20 -150.75 -94.55 0.06 Allowed 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.489 ' HD2' ' OD1' ' A' ' 42' ' ' ASN . 66.9 m-85 -154.77 168.88 25.39 Favored 'General case' 0 C--N 1.349 0.56 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.631 ' HG2' ' HG2' ' A' ' 18' ' ' ARG . 0.6 OUTLIER -95.66 -24.56 16.5 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.288 178.587 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.471 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 26.1 t -112.53 153.68 27.1 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 120.915 0.388 . . . . 0.0 111.665 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.4 -49.63 46.97 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.442 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.2 tt0 -56.32 -34.72 66.8 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.781 0.433 . . . . 0.0 111.151 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.471 ' OD2' ' HB3' ' A' ' 45' ' ' SER . 51.7 m-20 -72.7 -51.03 20.99 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.495 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.6 t -60.79 -30.81 70.27 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.181 178.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 63.9 mtt -75.74 -49.38 18.4 Favored 'General case' 0 C--N 1.345 0.376 0 C-N-CA 123.022 0.529 . . . . 0.0 111.434 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.448 ' HG2' ' HA ' ' A' ' 48' ' ' ASP . 17.4 ptm180 -61.35 -28.01 68.91 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.8 m -92.5 -61.99 1.49 Allowed 'General case' 0 CA--C 1.549 0.91 0 O-C-N 123.281 0.363 . . . . 0.0 111.681 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.495 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -92.32 -23.71 19.18 Favored 'General case' 0 C--N 1.346 0.429 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -178.426 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -89.13 47.05 3.31 Favored Glycine 0 C--N 1.339 0.7 0 C-N-CA 120.837 -0.697 . . . . 0.0 113.043 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 173.19 -67.17 0.11 Allowed Glycine 0 C--N 1.338 0.687 0 C-N-CA 121.47 -0.395 . . . . 0.0 112.478 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.22 0 C-N-CA 124.036 0.934 . . . . 0.0 112.309 179.97 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.55 ' OD2' HD13 ' A' ' 4' ' ' LEU . 1.5 m-20 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 120.531 0.205 . . . . 0.0 111.08 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.68 -21.26 1.73 Allowed 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -89.29 -13.84 37.14 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.634 HD22 ' HE2' ' A' ' 21' ' ' TYR . 75.2 mt -79.2 -8.5 59.06 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -95.56 153.92 39.37 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -66.34 167.0 19.64 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 123.058 2.506 . . . . 0.0 112.776 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.504 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 55.8 Cg_endo -60.87 126.0 18.56 Favored 'Trans proline' 0 C--N 1.375 1.974 0 C-N-CA 123.151 2.568 . . . . 0.0 112.542 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.519 ' CZ ' ' HD3' ' A' ' 37' ' ' ARG . 6.6 t80 -94.01 7.24 45.84 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.412 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.48 HG22 ' O ' ' A' ' 32' ' ' VAL . 7.3 m -55.79 -11.51 1.01 Allowed 'General case' 0 N--CA 1.484 1.244 0 O-C-N 122.272 -0.267 . . . . 0.0 111.615 179.15 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 53.14 -154.79 6.23 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.581 -0.736 . . . . 0.0 113.177 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -85.06 34.17 0.5 Allowed 'Trans proline' 0 C--N 1.367 1.505 0 C-N-CA 123.004 2.469 . . . . 0.0 112.292 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 34.5 m -87.56 -66.68 0.89 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.785 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 64.9 96.4 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.847 0.859 . . . . 0.0 111.701 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.492 ' HB3' ' H ' ' A' ' 15' ' ' ARG . . . -91.51 -141.1 0.18 Allowed 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.185 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.519 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 2.4 ppt_? -135.21 24.28 3.52 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.163 0.506 . . . . 0.0 111.748 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.502 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 33.0 mt -132.56 102.47 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.29 -179.179 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.666 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.2 mp -91.12 150.39 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 121.368 0.604 . . . . 0.0 109.596 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.794 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 17.1 mtt180 -145.21 -158.89 0.93 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.666 -178.492 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.602 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 5.7 m-85 -124.8 115.27 20.42 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -179.008 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.601 ' HB3' ' CD1' ' A' ' 31' ' ' PHE . 9.3 p90 -106.83 -167.65 1.31 Allowed 'General case' 0 CA--C 1.553 1.063 0 O-C-N 123.911 0.757 . . . . 0.0 109.565 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.634 ' HE2' HD22 ' A' ' 4' ' ' LEU . 0.8 OUTLIER -140.44 128.25 21.84 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.979 -0.451 . . . . 0.0 110.964 179.395 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -93.9 116.87 29.35 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 177.596 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.41 13.49 2.42 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.952 0.406 . . . . 0.0 111.31 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -97.04 -33.2 11.63 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.873 178.251 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.39 -47.49 3.38 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.157 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.08 -39.95 1.86 Allowed Glycine 0 C--N 1.345 1.043 0 C-N-CA 121.368 -0.444 . . . . 0.0 112.467 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.88 158.56 36.2 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -178.082 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.527 ' SG ' ' O ' ' A' ' 20' ' ' PHE . 35.9 t -97.49 118.86 34.93 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.047 178.769 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.472 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -104.78 -162.4 0.88 Allowed 'General case' 0 N--CA 1.466 0.329 0 O-C-N 122.989 0.181 . . . . 0.0 111.267 -177.565 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.588 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 37.3 p -114.38 154.81 27.42 Favored 'General case' 0 C--N 1.344 0.35 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.601 ' CD1' ' HB3' ' A' ' 20' ' ' PHE . 4.7 p90 -160.75 151.39 18.34 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.788 0.328 . . . . 0.0 110.796 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.666 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 5.8 t -87.07 136.49 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.31 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.917 ' HH ' ' HB2' ' A' ' 38' ' ' ALA . 44.0 t80 -102.18 111.27 23.48 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.701 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -100.06 151.55 19.18 Favored Glycine 0 C--N 1.336 0.551 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.661 -179.462 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -92.29 34.17 4.57 Favored Glycine 0 C--N 1.338 0.663 0 C-N-CA 121.511 -0.375 . . . . 0.0 112.739 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.5 p -95.26 -39.9 9.83 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 122.47 0.308 . . . . 0.0 111.15 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.519 ' HD3' ' CZ ' ' A' ' 8' ' ' TYR . 88.2 mtt-85 -129.51 -50.16 1.17 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.467 0.48 . . . . 0.0 110.81 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.917 ' HB2' ' HH ' ' A' ' 33' ' ' TYR . . . 60.18 136.38 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.111 0.964 . . . . 0.0 113.137 179.27 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -138.23 -170.77 2.88 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.397 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -104.55 52.07 0.76 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.464 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.525 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.3 OUTLIER -145.44 91.21 2.09 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.053 0.454 . . . . 0.0 110.727 179.125 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.794 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 7.5 m120 -153.68 131.5 11.62 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.117 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.602 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 35.5 m-85 -134.61 132.2 38.74 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.834 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.713 ' HD3' ' HE ' ' A' ' 18' ' ' ARG . 3.6 mmmp? -95.48 -5.1 43.7 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.889 -179.493 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -137.79 143.25 40.99 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.104 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.24 -53.31 38.49 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.658 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -55.14 -39.16 69.13 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.265 0.626 . . . . 0.0 111.917 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -74.34 -36.65 63.66 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 35.1 t -64.29 -27.74 69.24 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 115.074 -0.967 . . . . 0.0 110.017 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 94.1 mtp -80.55 -48.56 12.55 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.754 178.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.34 -38.65 43.15 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.128 0.571 . . . . 0.0 111.243 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.0 m -99.15 -54.72 2.89 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 123.308 0.38 . . . . 0.0 110.947 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -103.37 39.92 1.5 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -178.64 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -155.31 65.72 0.32 Allowed Glycine 0 C--N 1.332 0.308 0 CA-C-N 116.202 -0.453 . . . . 0.0 112.5 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -101.46 -83.69 1.75 Allowed Glycine 0 C--N 1.337 0.608 0 C-N-CA 121.495 -0.383 . . . . 0.0 112.469 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.09 -179.941 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.725 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 54.0 m-20 . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 120.488 0.185 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.538 ' O ' ' HB2' ' A' ' 41' ' ' ASN . 24.8 p90 -123.39 -34.37 3.11 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.7 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.37 -9.25 39.4 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.407 0.442 . . . . 0.0 111.017 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.725 ' HB2' ' HB3' ' A' ' 1' ' ' ASP . 2.8 mm? -83.13 -7.43 59.63 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.298 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -94.15 157.27 37.96 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 122.485 0.314 . . . . 0.0 111.244 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -62.9 171.51 5.92 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 122.943 2.429 . . . . 0.0 112.671 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.533 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 23.2 Cg_endo -53.01 133.88 53.63 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 123.515 2.81 . . . . 0.0 113.298 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.612 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 60.4 t80 -122.55 54.06 1.22 Allowed 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.261 -178.242 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.466 HG21 ' O ' ' A' ' 12' ' ' CYS . 20.4 m -96.08 12.59 30.08 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 36.71 -143.75 0.14 Allowed Glycine 0 CA--C 1.537 1.407 0 CA-C-N 114.287 -1.324 . . . . 0.0 114.398 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -81.13 1.8 9.04 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 123.111 2.541 . . . . 0.0 113.131 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.466 ' O ' HG21 ' A' ' 9' ' ' THR . 0.1 OUTLIER -98.12 149.11 22.86 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.879 -179.769 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -146.89 96.21 2.71 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.856 0.862 . . . . 0.0 109.381 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.996 ' HB1' ' HA3' ' A' ' 34' ' ' GLY . . . -79.4 33.92 0.25 Allowed 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.897 -1.047 . . . . 0.0 113.163 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.601 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER 44.9 26.83 0.23 Allowed 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 178.408 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.461 HG13 ' O ' ' A' ' 14' ' ' ALA . 28.4 mt -130.22 118.43 43.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.31 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 1.028 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 34.4 mt -81.07 139.24 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-O 121.624 0.726 . . . . 0.0 110.288 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.811 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 3.8 ttt180 -131.93 -170.49 2.41 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.927 -177.919 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.3 m-85 -126.3 154.06 43.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 122.487 0.315 . . . . 0.0 111.028 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.634 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 10.3 p90 -144.75 158.6 43.72 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.376 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.583 ' HE2' HD23 ' A' ' 4' ' ' LEU . 12.3 t80 -90.87 120.34 31.81 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.621 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.432 ' C ' ' H ' ' A' ' 24' ' ' LYS . 3.9 m120 -103.48 100.22 10.07 Favored 'General case' 0 C--O 1.244 0.811 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 175.862 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.03 16.25 0.25 Allowed 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -178.974 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.432 ' H ' ' C ' ' A' ' 22' ' ' ASN . 79.9 tttt -96.2 -26.16 15.55 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.873 178.899 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.928 ' HB1' HD22 ' A' ' 27' ' ' LEU . . . -116.79 -38.08 3.51 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.317 -179.908 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 104.82 31.35 4.52 Favored Glycine 0 C--N 1.343 0.919 0 C-N-CA 121.276 -0.488 . . . . 0.0 113.304 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.928 HD22 ' HB1' ' A' ' 25' ' ' ALA . 0.5 OUTLIER -152.42 168.44 25.48 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.896 0.379 . . . . 0.0 111.499 179.509 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.535 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 97.7 m -94.54 127.5 40.52 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.772 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.557 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 52.5 tp60 -94.74 159.13 15.2 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.074 -179.02 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 37.0 p -94.98 124.53 39.08 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.666 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.713 ' O ' ' N ' ' A' ' 18' ' ' ARG . 3.7 p90 -155.58 160.93 40.87 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.287 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 1.028 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.5 t -72.8 -179.02 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.061 0 C-N-CA 123.294 0.638 . . . . 0.0 111.87 -177.081 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.682 ' HH ' ' HB3' ' A' ' 38' ' ' ALA . 48.7 t80 -148.71 155.76 41.45 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.037 -178.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.996 ' HA3' ' HB1' ' A' ' 14' ' ' ALA . . . -142.95 140.52 9.82 Favored Glycine 0 C--N 1.335 0.526 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.767 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -78.64 2.21 68.94 Favored Glycine 0 C--N 1.341 0.823 0 C-N-CA 121.523 -0.37 . . . . 0.0 113.036 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.56 -2.92 47.45 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -133.55 -13.33 2.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . 0.682 ' HB3' ' HH ' ' A' ' 33' ' ' TYR . . . -8.81 119.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.951 1.3 . . . . 0.0 114.389 -179.616 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.612 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 21.7 tptm -127.65 -108.88 0.29 Allowed 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.828 -178.457 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -153.27 -32.35 0.12 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.726 0.81 . . . . 0.0 111.684 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.549 ' ND2' ' HB2' ' A' ' 20' ' ' PHE . 14.2 t30 -67.8 -2.56 7.38 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.033 0.933 . . . . 0.0 113.396 -178.979 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.811 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 2.2 m120 -105.34 139.37 40.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.868 0.366 . . . . 0.0 110.716 -178.793 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.434 ' C ' ' HG2' ' A' ' 18' ' ' ARG . 5.5 m-85 -151.96 126.26 9.32 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.154 -178.049 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.736 ' HD2' ' HE ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -65.06 -39.78 93.75 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -179.774 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -99.67 128.73 45.77 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 120.987 0.422 . . . . 0.0 111.997 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.15 -41.23 99.24 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.993 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.427 ' O ' ' HB2' ' A' ' 51' ' ' ARG . 20.1 pt-20 -48.14 -55.91 9.14 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.917 0.76 . . . . 0.0 111.6 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -66.67 -45.94 77.29 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 122.457 0.303 . . . . 0.0 110.677 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.7 t -47.3 -51.91 17.8 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.809 0.693 . . . . 0.0 110.873 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.65 ' SD ' ' HA ' ' A' ' 27' ' ' LEU . 8.5 mmt -74.79 -33.26 62.21 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.955 0.502 . . . . 0.0 111.573 178.677 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.427 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 67.0 ttt180 -60.13 -29.27 68.52 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.163 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.4 m -101.55 -52.94 3.1 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.493 0.496 . . . . 0.0 110.824 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.41 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -102.7 28.8 5.78 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -178.467 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.464 ' HA2' ' HE3' ' A' ' 50' ' ' MET . . . -144.83 55.12 0.55 Allowed Glycine 0 N--CA 1.459 0.168 0 O-C-N 121.789 -0.569 . . . . 0.0 112.506 179.324 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 144.89 -66.14 0.44 Allowed Glycine 0 C--N 1.336 0.542 0 C-N-CA 121.47 -0.395 . . . . 0.0 112.499 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.255 0 C-N-CA 124.018 0.927 . . . . 0.0 112.305 179.993 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.3 t70 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.517 0.199 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.668 ' HB2' ' O ' ' A' ' 40' ' ' ARG . 4.3 p90 -128.28 -6.9 5.34 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.784 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.596 ' HB3' ' HB3' ' A' ' 21' ' ' TYR . 57.0 m -72.88 -50.99 20.43 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -84.16 43.53 0.95 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.427 0.632 . . . . 0.0 112.014 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -127.17 153.77 76.79 Favored Pre-proline 0 CA--C 1.537 0.476 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.446 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.95 134.77 41.32 Favored 'Trans proline' 0 C--N 1.371 1.725 0 C-N-CA 122.549 2.166 . . . . 0.0 113.396 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -57.87 141.02 95.71 Favored 'Trans proline' 0 C--N 1.372 1.776 0 C-N-CA 123.659 2.906 . . . . 0.0 113.86 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -117.06 102.38 9.28 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.463 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.0 m -95.93 -83.0 0.38 Allowed 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.73 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.14 137.64 8.29 Favored Glycine 0 C--N 1.341 0.824 0 CA-C-O 118.933 -0.926 . . . . 0.0 110.946 -178.399 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.05 83.16 0.26 Allowed 'Trans proline' 0 C--N 1.37 1.685 0 C-N-CA 122.802 2.334 . . . . 0.0 112.847 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.6 m -138.2 -167.6 2.2 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.33 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -99.7 72.5 1.75 Allowed 'General case' 0 C--O 1.238 0.476 0 CA-C-O 122.195 0.998 . . . . 0.0 108.834 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.78 ' HB3' ' HA3' ' A' ' 34' ' ' GLY . . . -77.45 -55.63 5.22 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 113.901 -1.5 . . . . 0.0 113.104 -177.886 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.562 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.3 OUTLIER 46.95 22.39 0.2 Allowed 'General case' 0 N--CA 1.497 1.884 0 C-N-CA 124.523 1.129 . . . . 0.0 113.792 -179.57 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.564 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 27.4 mt -135.76 142.02 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.431 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.874 HG13 HG21 ' A' ' 32' ' ' VAL . 4.5 mp -121.23 108.61 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 122.131 0.967 . . . . 0.0 108.952 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 1.023 ' HG2' ' HA ' ' A' ' 44' ' ' LYS . 27.2 mtt180 -86.5 -167.02 1.72 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 113.116 -1.857 . . . . 0.0 111.507 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.531 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 42.4 m-85 -128.91 151.16 49.95 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.622 ' HA ' ' CB ' ' A' ' 42' ' ' ASN . 3.8 p90 -147.52 155.52 41.95 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.294 0.371 . . . . 0.0 110.669 178.76 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.622 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 14.9 t80 -83.7 116.89 22.88 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -178.62 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.589 ' C ' ' H ' ' A' ' 24' ' ' LYS . 3.2 m120 -110.56 91.11 3.53 Favored 'General case' 0 C--O 1.246 0.902 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.253 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.02 15.86 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 120.944 0.402 . . . . 0.0 111.693 -179.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.589 ' H ' ' C ' ' A' ' 22' ' ' ASN . 46.5 tptt -97.78 -37.97 9.65 Favored 'General case' 0 C--N 1.345 0.372 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.455 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.85 ' HB2' HD22 ' A' ' 27' ' ' LEU . . . -99.18 -15.27 18.99 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.073 179.092 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.02 13.28 72.11 Favored Glycine 0 C--N 1.349 1.265 0 N-CA-C 114.663 0.625 . . . . 0.0 114.663 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.85 HD22 ' HB2' ' A' ' 25' ' ' ALA . 2.2 pt? -154.3 -176.01 5.67 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 117.307 0.554 . . . . 0.0 111.378 -179.521 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.492 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 31.5 m -84.6 156.38 21.61 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.989 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.617 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 56.1 tp60 -134.78 153.78 51.88 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-O 120.961 0.41 . . . . 0.0 110.395 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -78.26 122.97 26.41 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.43 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.72 ' O ' ' N ' ' A' ' 18' ' ' ARG . 3.0 p90 -141.91 142.07 33.02 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.49 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.874 HG21 HG13 ' A' ' 17' ' ' ILE . 48.3 t -78.01 126.76 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 123.984 0.914 . . . . 0.0 111.462 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 42.1 t80 -112.23 131.8 55.29 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.168 179.629 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.78 ' HA3' ' HB3' ' A' ' 14' ' ' ALA . . . -89.64 153.59 23.36 Favored Glycine 0 C--N 1.34 0.801 0 O-C-N 123.701 0.625 . . . . 0.0 113.238 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.31 8.89 69.62 Favored Glycine 0 C--N 1.338 0.656 0 O-C-N 123.82 0.364 . . . . 0.0 113.162 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.2 p -94.94 -43.83 7.99 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 122.503 0.321 . . . . 0.0 110.876 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.3 mtt-85 -119.27 124.47 46.78 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.942 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -111.59 138.07 48.62 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.899 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.565 ' HZ1' ' H ' ' A' ' 40' ' ' ARG . 0.5 OUTLIER -142.98 -170.72 3.31 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.859 179.575 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . 0.668 ' O ' ' HB2' ' A' ' 2' ' ' PHE . 80.4 mmt-85 -121.62 91.31 3.49 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.714 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.574 ' O ' ' HD1' ' A' ' 2' ' ' PHE . 46.3 t30 -107.57 -52.59 2.74 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.972 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.622 ' CB ' ' HA ' ' A' ' 20' ' ' PHE . 1.1 m120 -160.82 -103.01 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.447 0.467 . . . . 0.0 110.431 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 55.0 m-85 -150.96 -173.8 4.6 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -177.151 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 1.023 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 12.5 tppt? -97.79 -42.24 7.68 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.688 177.741 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.5 m -108.86 155.32 20.95 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.906 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -68.41 -37.35 80.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.92 -179.76 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -54.35 -50.94 66.27 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.701 0.4 . . . . 0.0 111.643 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -70.52 -52.33 22.56 Favored 'General case' 0 C--N 1.345 0.39 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.969 178.407 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.432 ' SG ' ' ND2' ' A' ' 42' ' ' ASN . 41.9 t -49.5 -34.59 17.48 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.187 0.595 . . . . 0.0 112.309 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.606 ' HA ' ' HA2' ' A' ' 54' ' ' GLY . 59.0 mtt -78.77 -47.16 17.32 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 122.941 0.496 . . . . 0.0 111.607 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -58.05 -33.32 68.9 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 123.799 0.687 . . . . 0.0 111.58 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.9 m -86.22 -55.16 4.05 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.622 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 2.2 p -149.61 74.25 1.22 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.059 0.457 . . . . 0.0 112.118 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.606 ' HA2' ' HA ' ' A' ' 50' ' ' MET . . . -178.59 50.74 0.09 OUTLIER Glycine 0 C--N 1.339 0.715 0 C-N-CA 121.199 -0.525 . . . . 0.0 112.728 179.179 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 160.0 46.75 0.02 OUTLIER Glycine 0 C--N 1.339 0.701 0 C-N-CA 121.444 -0.408 . . . . 0.0 112.777 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.148 179.978 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 120.505 0.193 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.469 ' HE1' ' CZ ' ' A' ' 43' ' ' PHE . 1.3 p90 -125.93 -26.06 3.51 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.044 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.542 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 24.9 t -86.67 -14.15 43.42 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.222 0.326 . . . . 0.0 111.807 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.511 HD23 ' CE2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -79.67 -8.69 59.37 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 179.966 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -95.6 157.54 35.94 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -70.58 167.73 24.66 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.85 2.366 . . . . 0.0 112.523 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.469 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 37.9 Cg_endo -58.25 132.92 51.85 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 123.257 2.638 . . . . 0.0 112.968 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -92.72 -0.53 57.26 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.446 HG22 ' O ' ' A' ' 32' ' ' VAL . 8.7 m -40.87 -22.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.901 0.88 . . . . 0.0 113.218 -179.745 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 55.65 -150.92 20.75 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-O 119.409 -0.662 . . . . 0.0 113.511 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -81.9 13.17 2.56 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 123.159 2.573 . . . . 0.0 112.484 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.5 m -84.89 154.58 22.15 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.889 -179.591 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -133.32 73.42 1.51 Allowed 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.341 0.591 . . . . 0.0 111.19 -179.345 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.72 ' HB3' HH21 ' A' ' 15' ' ' ARG . . . -86.92 172.26 10.18 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.411 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.801 ' H ' ' HE ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -110.79 45.14 1.18 Allowed 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.015 0.436 . . . . 0.0 111.521 -179.414 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.836 HG21 ' HZ2' ' A' ' 44' ' ' LYS . 25.3 mt -131.81 92.08 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -179.964 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 1.047 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.1 mp -76.24 144.25 12.07 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-O 121.565 0.697 . . . . 0.0 110.131 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.92 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 68.1 mtt180 -150.56 -178.23 6.43 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.41 -177.677 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.819 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 1.5 m-85 -123.31 152.98 40.88 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.469 ' CE2' ' HD3' ' A' ' 7' ' ' PRO . 8.1 p90 -144.76 168.7 19.58 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 124.054 0.846 . . . . 0.0 109.582 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.66 ' CD2' ' HB2' ' A' ' 53' ' ' CYS . 3.8 t80 -106.86 128.87 54.66 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.418 ' C ' ' H ' ' A' ' 24' ' ' LYS . 69.1 m-80 -105.97 109.95 22.07 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 175.43 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.79 21.3 0.68 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.249 0.547 . . . . 0.0 110.805 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.418 ' H ' ' C ' ' A' ' 22' ' ' ASN . 12.7 tppt? -96.19 -23.74 16.58 Favored 'General case' 0 C--N 1.345 0.405 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.522 178.908 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -127.52 -31.15 2.52 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.198 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.423 ' HA3' ' HE1' ' A' ' 21' ' ' TYR . . . 95.44 31.29 7.6 Favored Glycine 0 C--N 1.344 0.978 0 O-C-N 123.391 0.432 . . . . 0.0 112.292 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 pp -135.72 163.53 29.96 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-O 121.007 0.432 . . . . 0.0 111.896 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.819 ' SG ' ' HB3' ' A' ' 19' ' ' TYR . 48.9 t -98.5 119.01 36.47 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.625 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.432 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 3.5 tm0? -96.16 153.01 18.03 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.563 -178.074 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.456 HG23 ' CZ ' ' A' ' 19' ' ' TYR . 46.2 p -90.38 123.11 33.85 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.019 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.443 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 2.6 p90 -143.08 138.05 29.63 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.701 -179.364 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 1.047 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.0 t -80.21 88.43 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.524 1.13 . . . . 0.0 113.009 -178.257 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.487 ' HB3' ' HD2' ' A' ' 18' ' ' ARG . 25.0 t80 -52.27 125.38 15.74 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.962 0.505 . . . . 0.0 110.995 178.445 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.475 ' HA3' ' CB ' ' A' ' 14' ' ' ALA . . . -83.26 150.46 27.34 Favored Glycine 0 C--N 1.34 0.789 0 CA-C-N 115.871 -0.604 . . . . 0.0 113.495 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.41 23.61 23.97 Favored Glycine 0 C--N 1.339 0.716 0 O-C-N 123.785 0.344 . . . . 0.0 112.898 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.9 p -95.06 -46.93 6.6 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.526 0.33 . . . . 0.0 110.451 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -126.57 126.58 43.89 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.65 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -100.93 131.42 46.81 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -145.54 165.14 29.5 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.052 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 46.9 mmm-85 -78.3 1.63 21.14 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.823 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.602 ' C ' HD21 ' A' ' 41' ' ' ASN . 0.2 OUTLIER -89.8 72.61 7.6 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 120.924 0.393 . . . . 0.0 110.431 179.339 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.92 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 74.4 m-80 -156.7 133.69 10.37 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.718 179.172 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.524 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 31.9 m-85 -137.78 101.77 4.55 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.991 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.836 ' HZ2' HG21 ' A' ' 16' ' ' ILE . 51.6 mmtt -67.13 -22.85 65.77 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.9 m -113.76 133.31 55.45 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.763 0.316 . . . . 0.0 111.834 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.93 -47.59 77.15 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.915 179.108 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -48.14 -56.77 7.04 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 123.918 0.761 . . . . 0.0 110.661 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . 0.681 ' HA ' ' HG2' ' A' ' 51' ' ' ARG . 57.1 m-20 -58.99 -49.66 77.04 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 122.608 0.363 . . . . 0.0 110.588 178.765 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.5 t -46.4 -49.74 17.59 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 123.934 0.771 . . . . 0.0 111.135 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 96.0 mtp -68.9 -43.55 75.02 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.681 ' HG2' ' HA ' ' A' ' 48' ' ' ASP . 33.3 ptt180 -70.21 -16.19 63.02 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.8 m -102.94 -49.56 3.75 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 123.209 0.318 . . . . 0.0 110.604 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.66 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 1.3 p -123.48 34.81 5.0 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -128.38 -99.37 0.97 Allowed Glycine 0 N--CA 1.459 0.197 0 C-N-CA 121.083 -0.58 . . . . 0.0 112.458 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.58 61.11 0.04 OUTLIER Glycine 0 C--N 1.337 0.614 0 C-N-CA 121.397 -0.43 . . . . 0.0 112.45 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.088 -179.999 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . 0.494 ' OD2' HD23 ' A' ' 4' ' ' LEU . 47.8 t0 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.553 0.216 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -128.5 -173.21 2.9 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.104 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.532 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 26.4 t 70.64 -47.9 0.65 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.705 1.202 . . . . 0.0 112.796 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.532 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 3.7 pp -81.85 -6.38 59.03 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . 0.45 ' HB3' ' HD2' ' A' ' 6' ' ' PRO . 55.2 mm-40 -87.32 163.85 37.89 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.562 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . 0.45 ' HD2' ' HB3' ' A' ' 5' ' ' GLU . 13.7 Cg_endo -56.36 130.12 38.42 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.555 2.17 . . . . 0.0 113.223 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.532 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 21.4 Cg_endo -52.71 136.04 57.7 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 124.121 3.214 . . . . 0.0 114.408 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -130.1 117.49 20.05 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.612 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.406 HG21 ' HA ' ' A' ' 33' ' ' TYR . 41.2 m -96.28 -71.94 0.65 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.378 179.389 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.459 ' HA2' ' CB ' ' A' ' 37' ' ' ARG . . . 112.03 147.66 10.58 Favored Glycine 0 C--N 1.34 0.775 0 CA-C-O 119.146 -0.808 . . . . 0.0 111.511 -178.772 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.401 ' HD3' ' HA3' ' A' ' 10' ' ' GLY . 2.7 Cg_exo -76.4 49.12 2.54 Favored 'Trans proline' 0 C--N 1.368 1.553 0 C-N-CA 122.882 2.388 . . . . 0.0 113.055 -179.363 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . 0.653 ' HB2' ' HG2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -146.53 133.04 19.73 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.309 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.693 ' HE2' ' H ' ' A' ' 13' ' ' LYS . 0.4 OUTLIER 28.99 47.28 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 125.196 1.398 . . . . 0.0 114.549 178.796 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.668 ' HA ' ' HA3' ' A' ' 34' ' ' GLY . . . -89.52 100.25 13.09 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.913 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -155.54 30.56 0.38 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.386 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.551 ' O ' HG11 ' A' ' 32' ' ' VAL . 46.8 mt -143.07 128.92 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.692 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.792 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.2 mp -93.66 142.8 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.731 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.648 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 37.8 mtt180 -137.19 -176.24 4.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.678 -177.723 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.527 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.1 m-85 -116.64 148.03 41.36 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.686 0.279 . . . . 0.0 111.584 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.794 ' HB2' HD22 ' A' ' 41' ' ' ASN . 2.9 p90 -139.54 155.63 47.39 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.577 ' CZ ' ' HA3' ' A' ' 26' ' ' GLY . 68.4 t80 -90.38 131.97 35.86 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -99.87 130.46 46.06 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 176.962 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.39 9.93 27.06 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 123.349 0.406 . . . . 0.0 111.781 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -97.61 -24.74 15.39 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.048 179.301 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -134.97 -28.93 1.15 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.672 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . 0.577 ' HA3' ' CZ ' ' A' ' 21' ' ' TYR . . . 95.95 8.62 57.89 Favored Glycine 0 C--N 1.342 0.914 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.297 -178.763 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 pp -95.7 151.61 19.21 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 123.834 0.373 . . . . 0.0 111.901 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.479 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 96.4 m -96.13 109.97 22.32 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.124 178.73 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.574 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 53.4 tp60 -92.15 156.94 17.0 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.031 -177.542 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.455 HG23 ' CE1' ' A' ' 19' ' ' TYR . 34.0 p -89.78 128.37 36.13 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.294 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.566 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 6.9 p90 -150.66 150.52 31.23 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.796 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.792 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.2 t -76.74 161.35 4.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 123.656 0.783 . . . . 0.0 112.395 -177.972 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.489 ' N ' ' O ' ' A' ' 16' ' ' ILE . 32.7 t80 -136.85 158.17 45.08 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.904 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.668 ' HA3' ' HA ' ' A' ' 14' ' ' ALA . . . -105.76 -164.33 23.31 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 121.146 -0.549 . . . . 0.0 113.324 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . 0.51 ' HA2' ' HB2' ' A' ' 13' ' ' LYS . . . -109.47 -60.83 0.52 Allowed Glycine 0 C--N 1.339 0.699 0 O-C-N 123.788 0.346 . . . . 0.0 112.716 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . 0.549 ' SG ' ' HD2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -80.05 -19.56 47.31 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 179.757 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.653 ' HG2' ' HB2' ' A' ' 12' ' ' CYS . 71.9 mmt-85 -96.85 102.95 14.82 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.053 0.454 . . . . 0.0 110.851 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -120.42 148.49 43.72 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.569 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.9 tmtp? -137.13 -124.78 0.14 Allowed 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.482 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -143.99 -1.24 0.98 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.781 0.433 . . . . 0.0 111.622 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.794 HD22 ' HB2' ' A' ' 20' ' ' PHE . 0.2 OUTLIER -109.15 78.48 1.14 Allowed 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.807 0.337 . . . . 0.0 111.737 -179.058 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.648 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 9.3 m120 -155.63 123.89 5.85 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.81 177.472 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.522 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 36.5 m-85 -134.65 103.32 5.61 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.138 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.406 ' HG2' ' HG2' ' A' ' 18' ' ' ARG . 6.5 tmtt? -74.31 0.62 13.73 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.002 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.2 m -134.92 134.22 40.4 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.269 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.93 -45.99 86.75 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.295 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -49.11 -55.96 10.6 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.781 0.676 . . . . 0.0 110.786 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -62.53 -47.45 83.84 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 122.398 0.279 . . . . 0.0 110.763 178.768 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.506 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 53.7 t -46.68 -48.96 20.0 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 123.824 0.702 . . . . 0.0 111.37 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.5 mtt -73.69 -39.26 64.51 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 86.8 mtm180 -69.13 -19.76 64.03 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.5 m -105.72 -51.49 2.99 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 122.983 0.177 . . . . 0.0 110.841 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.506 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.2 OUTLIER -109.42 21.04 17.55 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -178.681 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.23 -62.56 0.58 Allowed Glycine 0 C--N 1.34 0.755 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.545 178.589 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.85 79.09 0.04 OUTLIER Glycine 0 C--N 1.337 0.611 0 C-N-CA 121.467 -0.396 . . . . 0.0 112.493 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.251 -0.88 . . . . 0.0 111.087 179.975 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 N--CA 1.488 1.468 0 CA-C-O 120.519 0.2 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -127.82 -164.87 1.41 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.238 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . 0.702 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 13.9 t 72.51 -39.66 0.45 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.808 1.243 . . . . 0.0 112.35 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . 0.421 HD22 ' CD1' ' A' ' 21' ' ' TYR . 23.1 mt -79.51 -4.95 53.67 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -95.14 151.37 38.74 Favored Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.198 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 39.2 Cg_endo -67.18 169.34 15.43 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.927 2.418 . . . . 0.0 112.908 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . 0.571 ' HD3' ' CZ ' ' A' ' 20' ' ' PHE . 36.5 Cg_endo -57.81 130.01 36.35 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 123.037 2.491 . . . . 0.0 113.101 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.941 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 9.9 t80 -95.22 -19.76 19.77 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.592 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.6 m -8.94 -80.67 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.613 0.765 . . . . 0.0 109.609 -176.876 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.39 -159.47 19.01 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.611 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -78.72 13.07 2.0 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 123.073 2.515 . . . . 0.0 113.143 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.6 m -94.85 -59.53 1.89 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.928 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt 57.51 91.23 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.095 0.958 . . . . 0.0 112.33 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.624 ' HB1' ' HA3' ' A' ' 34' ' ' GLY . . . -80.98 -158.33 0.2 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.402 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.68 37.71 4.25 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.071 0.462 . . . . 0.0 111.814 -179.513 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.0 mt -129.96 91.74 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.712 -179.641 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.671 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 2.9 mp -76.39 153.87 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.079 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.609 HH11 ' ND2' ' A' ' 42' ' ' ASN . 39.2 mtt180 -154.8 -179.59 8.17 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.625 -177.952 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.739 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 2.2 m-85 -112.39 156.91 21.72 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-N 118.32 0.509 . . . . 0.0 111.731 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.571 ' CZ ' ' HD3' ' A' ' 7' ' ' PRO . 1.8 p90 -158.56 167.05 30.63 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 124.597 1.186 . . . . 0.0 108.981 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.702 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 5.5 t80 -81.71 133.8 35.39 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 118.419 0.554 . . . . 0.0 112.166 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.553 ' ND2' ' HB3' ' A' ' 29' ' ' GLN . 67.8 m-80 -141.27 112.88 7.61 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.104 178.471 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.92 7.28 4.99 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.0 177.969 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . 0.402 ' H ' ' C ' ' A' ' 22' ' ' ASN . 18.4 ttmm -96.87 -41.04 8.63 Favored 'General case' 0 C--N 1.348 0.537 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.017 179.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.44 -48.05 9.37 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.981 179.632 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 169.49 -62.54 0.18 Allowed Glycine 0 C--N 1.336 0.576 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.659 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.725 HD11 ' N ' ' A' ' 28' ' ' CYS . 2.3 pp -150.62 -52.49 0.14 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.368 0.267 . . . . 0.0 110.822 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . 0.725 ' N ' HD11 ' A' ' 27' ' ' LEU . 58.5 m -133.86 144.64 49.05 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.538 0.335 . . . . 0.0 110.24 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.553 ' HB3' ' ND2' ' A' ' 22' ' ' ASN . 63.3 tp60 -145.81 159.23 43.5 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.405 0.622 . . . . 0.0 112.273 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . 0.513 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 34.9 p -77.54 142.28 39.12 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 113.946 -1.479 . . . . 0.0 112.244 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.599 ' O ' ' HA ' ' A' ' 17' ' ' ILE . 6.7 p90 -152.64 147.35 26.04 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.388 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.671 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.2 t -99.13 110.37 26.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.241 0.617 . . . . 0.0 111.363 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.8 t80 -78.49 136.07 37.5 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.702 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . 0.624 ' HA3' ' HB1' ' A' ' 14' ' ' ALA . . . -92.59 155.59 22.75 Favored Glycine 0 C--N 1.338 0.664 0 O-C-N 123.561 0.538 . . . . 0.0 112.906 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -98.66 11.95 62.87 Favored Glycine 0 C--N 1.337 0.625 0 C-N-CA 121.433 -0.413 . . . . 0.0 113.346 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 17.5 p -95.14 -44.61 7.56 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.771 0.285 . . . . 0.0 110.73 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -124.76 153.49 42.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.025 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -100.6 151.02 22.1 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.276 0.56 . . . . 0.0 112.161 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.941 ' HD3' ' HB3' ' A' ' 8' ' ' TYR . 13.0 ttpp -134.07 165.18 25.66 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.356 -179.194 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 86.4 mtm180 -112.47 18.7 18.23 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.648 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.851 ' H ' ' HG2' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -126.96 97.45 4.97 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.172 0.51 . . . . 0.0 110.936 179.751 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.609 ' ND2' HH11 ' A' ' 18' ' ' ARG . 8.3 m120 -146.23 147.93 31.95 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.543 178.711 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.739 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 56.1 m-85 -160.53 81.19 0.67 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.759 0.662 . . . . 0.0 109.853 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . 0.526 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 20.2 tptm -43.25 -28.04 0.28 Allowed 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -178.158 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.4 m -136.65 154.91 50.51 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.666 0.269 . . . . 0.0 111.636 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -59.62 -50.62 73.17 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.51 179.028 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.474 ' O ' ' HB2' ' A' ' 51' ' ' ARG . 71.8 tt0 -43.63 -51.13 7.18 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.931 0.77 . . . . 0.0 110.474 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -66.07 -39.14 89.82 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.42 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.476 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 41.9 t -55.5 -59.24 5.11 Favored 'General case' 0 C--N 1.355 0.843 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' MET . . . . . 0.516 ' HA ' ' HA2' ' A' ' 54' ' ' GLY . 66.9 mtt -60.97 -31.96 71.52 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 122.884 0.474 . . . . 0.0 111.011 177.913 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . 0.474 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 5.4 tmm_? -58.11 -41.94 84.65 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.57 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.481 ' HB ' ' CZ ' ' A' ' 43' ' ' PHE . 7.6 m -101.24 -51.31 3.54 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.13 12.04 37.4 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -178.529 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . 0.516 ' HA2' ' HA ' ' A' ' 50' ' ' MET . . . -98.87 -61.06 0.87 Allowed Glycine 0 C--N 1.341 0.841 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.581 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -111.75 -103.09 2.67 Favored Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.4 -0.429 . . . . 0.0 112.549 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.988 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.014 -179.961 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.532 0.206 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' PHE . . . . . 0.492 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 2.5 p90 -104.57 -29.76 10.44 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.926 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -83.57 -35.69 24.54 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.3 mm? -80.54 -8.18 59.49 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.547 179.083 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -112.26 155.39 43.65 Favored Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.395 179.307 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -61.52 142.83 96.3 Favored 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 122.706 2.27 . . . . 0.0 113.392 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -61.56 165.35 13.61 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 123.522 2.815 . . . . 0.0 113.395 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . 0.709 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 15.1 t80 -125.57 35.18 4.77 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.623 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.523 HG22 ' O ' ' A' ' 32' ' ' VAL . 7.0 m -57.92 -41.69 83.22 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.093 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' GLY . . . . . 0.621 ' HA2' ' NE ' ' A' ' 37' ' ' ARG . . . 70.91 -165.17 53.14 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.318 -0.712 . . . . 0.0 113.027 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PRO . . . . . 0.425 ' HD3' HH21 ' A' ' 37' ' ' ARG . 3.0 Cg_exo -80.83 16.75 1.54 Allowed 'Trans proline' 0 C--N 1.368 1.566 0 C-N-CA 123.052 2.501 . . . . 0.0 112.824 179.433 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.77 114.86 22.78 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.624 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -142.04 83.23 1.83 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.154 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . 0.519 ' HB2' ' HD3' ' A' ' 15' ' ' ARG . . . -78.44 -104.44 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.107 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ARG . . . . . 0.556 ' HD3' ' N ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -137.98 34.36 2.37 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.044 0.45 . . . . 0.0 112.197 -178.428 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ILE . . . . . 0.521 ' HB ' ' O ' ' A' ' 33' ' ' TYR . 23.1 mt -127.54 61.92 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-O 121.801 0.81 . . . . 0.0 109.62 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ILE . . . . . 0.918 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.5 mp -69.82 126.7 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.57 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ARG . . . . . 0.957 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 71.2 mtt180 -127.64 -179.73 5.08 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 113.032 -1.895 . . . . 0.0 108.805 -179.548 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' TYR . . . . . 0.67 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.5 m-85 -111.45 153.92 25.43 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -177.835 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . 0.579 ' CE2' ' HB3' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -142.98 145.15 32.69 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 178.465 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' TYR . . . . . 0.462 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 44.9 t80 -101.39 119.21 38.41 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' ASN . . . . . 0.407 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 0.2 OUTLIER -80.21 93.72 5.92 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.768 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -56.9 -13.32 2.54 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.673 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 tttm -95.55 -34.65 11.95 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 118.401 0.546 . . . . 0.0 110.942 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' ALA . . . . . 0.905 ' HB1' HD12 ' A' ' 27' ' ' LEU . . . -79.62 -31.42 41.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.914 -179.938 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.6 -15.23 61.26 Favored Glycine 0 C--N 1.34 0.785 0 O-C-N 123.414 0.446 . . . . 0.0 112.999 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LEU . . . . . 0.905 HD12 ' HB1' ' A' ' 25' ' ' ALA . 0.0 OUTLIER -115.55 170.64 8.27 Favored 'General case' 0 C--O 1.244 0.764 0 CA-C-O 121.141 0.496 . . . . 0.0 112.122 -179.395 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.5 t -93.55 157.64 16.09 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.154 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' GLN . . . . . 0.579 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 25.2 tt0 -144.88 130.95 19.37 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.172 -178.983 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.3 p -77.33 139.65 39.82 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PHE . . . . . 0.616 ' O ' ' N ' ' A' ' 18' ' ' ARG . 18.4 p90 -138.13 159.41 42.1 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.625 179.421 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' VAL . . . . . 0.918 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.1 t -97.89 164.52 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 123.643 0.777 . . . . 0.0 110.512 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.521 ' O ' ' HB ' ' A' ' 16' ' ' ILE . 45.3 t80 -137.49 157.21 47.04 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.693 179.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.14 -167.11 19.38 Favored Glycine 0 C--N 1.337 0.628 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.027 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.72 12.57 69.06 Favored Glycine 0 C--N 1.34 0.775 0 C-N-CA 121.609 -0.329 . . . . 0.0 113.185 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.99 -34.75 12.24 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 122.761 0.425 . . . . 0.0 112.007 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' ARG . . . . . 0.621 ' NE ' ' HA2' ' A' ' 10' ' ' GLY . 87.2 mtt-85 -132.36 150.95 52.05 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.22 0.325 . . . . 0.0 110.513 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -142.98 118.04 10.07 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.414 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.709 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 0.2 OUTLIER -148.42 174.93 11.56 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.228 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -75.97 -51.28 12.74 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.16 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASN . . . . . 0.492 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -53.49 92.28 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.405 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ASN . . . . . 0.957 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 8.5 m120 -157.78 109.22 2.28 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 114.559 -1.201 . . . . 0.0 108.914 177.697 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PHE . . . . . 0.67 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 0.7 OUTLIER -97.42 -168.53 1.7 Allowed 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -176.655 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.93 -68.58 0.82 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 113.242 -1.799 . . . . 0.0 112.609 178.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.439 ' HA ' ' CE2' ' A' ' 19' ' ' TYR . 52.6 m -154.43 177.35 11.26 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.268 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.32 -37.32 72.32 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.48 -54.46 46.35 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 123.356 0.41 . . . . 0.0 111.187 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -73.23 -31.73 64.32 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.603 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' CYS . . . . . 0.432 ' HA ' ' CE2' ' A' ' 43' ' ' PHE . 7.6 t -58.94 -40.8 85.76 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.374 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 74.0 mtm -84.03 -34.21 24.33 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 123.627 0.579 . . . . 0.0 110.533 178.183 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -54.6 -38.14 66.42 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.705 178.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' THR . . . . . 0.491 ' HB ' ' HZ ' ' A' ' 43' ' ' PHE . 11.5 m -100.37 -48.04 4.71 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.57 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' CYS . . . . . 0.462 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -116.1 55.16 0.81 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -179.145 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -103.19 -55.75 0.8 Allowed Glycine 0 C--N 1.335 0.475 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.48 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 140.78 57.3 0.04 OUTLIER Glycine 0 C--N 1.336 0.581 0 C-N-CA 121.415 -0.421 . . . . 0.0 112.453 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.088 -179.963 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 120.55 0.214 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.48 ' HB2' ' HA ' ' A' ' 41' ' ' ASN . 0.4 OUTLIER -129.7 52.03 2.03 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.376 0.608 . . . . 0.0 111.314 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.0 t -128.93 -51.07 1.22 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.733 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -100.58 8.44 43.44 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 123.47 0.481 . . . . 0.0 112.135 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.47 ' HB2' ' OD1' ' A' ' 41' ' ' ASN . 55.3 mm-40 -89.87 141.2 28.01 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.121 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 4.2 Cg_exo -75.7 159.37 38.88 Favored 'Trans proline' 0 C--N 1.369 1.613 0 C-N-CA 123.107 2.538 . . . . 0.0 113.085 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.587 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 58.7 Cg_endo -63.1 148.12 93.62 Favored 'Trans proline' 0 C--N 1.37 1.709 0 C-N-CA 123.518 2.812 . . . . 0.0 113.619 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -107.8 45.9 0.98 Allowed 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.39 0.614 . . . . 0.0 110.83 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.639 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 21.8 m -54.17 -48.25 71.11 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.755 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 54.66 -150.89 16.19 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-O 119.291 -0.727 . . . . 0.0 113.22 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -87.84 15.74 2.06 Favored 'Trans proline' 0 C--N 1.366 1.45 0 C-N-CA 122.968 2.446 . . . . 0.0 113.344 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -140.87 120.17 13.03 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.422 0.289 . . . . 0.0 111.541 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.752 ' HE2' ' HA ' ' A' ' 33' ' ' TYR . 2.1 tptm -179.16 108.28 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.969 1.308 . . . . 0.0 108.114 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.579 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -76.66 -141.82 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.881 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.45 ' CZ ' ' HB1' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -104.45 46.1 0.93 Allowed 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.168 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.0 mt -129.0 90.59 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 1.058 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.2 mp -76.5 144.67 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-O 121.73 0.776 . . . . 0.0 110.58 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.751 ' HG2' ' HA ' ' A' ' 44' ' ' LYS . 4.8 ttt180 -134.2 -160.32 1.04 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 113.633 -1.621 . . . . 0.0 110.237 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -132.78 147.24 52.31 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.659 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 6.2 p90 -144.97 141.94 29.39 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.57 ' CE2' ' HG2' ' A' ' 50' ' ' MET . 17.3 t80 -84.47 120.7 26.61 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.515 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 0.7 OUTLIER -97.0 95.85 8.09 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.362 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.88 -14.17 0.19 Allowed 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -178.197 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -95.91 -26.66 15.51 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 117.536 0.153 . . . . 0.0 111.214 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB3' ' HB2' ' A' ' 22' ' ' ASN . . . -85.1 -44.84 12.64 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.515 0.509 . . . . 0.0 111.689 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.69 -8.34 25.95 Favored Glycine 0 C--N 1.343 0.923 0 C-N-CA 121.25 -0.5 . . . . 0.0 113.495 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.515 ' N ' HD13 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -141.56 175.31 9.78 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.947 0.374 . . . . 0.0 111.708 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 94.4 m -94.42 102.89 14.87 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.635 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.5 tp60 -79.76 148.36 31.5 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.644 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 40.7 p -78.41 121.95 25.18 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.076 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.691 ' O ' ' N ' ' A' ' 18' ' ' ARG . 5.5 p90 -138.83 154.03 48.41 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 114.195 -1.366 . . . . 0.0 108.253 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 1.058 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 14.3 t -76.94 163.7 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 CA-C-N 118.508 0.595 . . . . 0.0 112.407 -178.071 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.752 ' HA ' ' HE2' ' A' ' 13' ' ' LYS . 55.3 t80 -117.5 146.54 43.47 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.099 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -119.12 151.16 17.72 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 120.996 -0.621 . . . . 0.0 113.213 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.16 -15.01 46.36 Favored Glycine 0 C--N 1.339 0.702 0 O-C-N 123.86 0.388 . . . . 0.0 112.733 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.94 -34.85 17.97 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 122.704 0.402 . . . . 0.0 111.693 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -97.34 -72.06 0.66 Allowed 'General case' 0 CA--C 1.536 0.411 0 O-C-N 123.233 0.333 . . . . 0.0 110.443 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 47.55 117.95 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.581 1.152 . . . . 0.0 113.888 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -131.74 -173.17 3.06 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.26 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -75.53 -47.81 25.26 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.448 -177.312 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.599 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.2 OUTLIER -69.98 76.57 0.48 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.217 0.532 . . . . 0.0 111.627 -179.523 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -154.74 128.51 8.69 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.095 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.54 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 56.9 m-85 -129.97 135.21 48.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.137 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.751 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 3.2 tppp? -80.1 -38.89 30.73 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 123.267 0.354 . . . . 0.0 111.872 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.8 m -111.87 138.53 48.35 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 123.234 0.334 . . . . 0.0 111.661 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.63 -31.62 72.85 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.709 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.4 mp0 -63.56 -56.9 12.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.347 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -68.75 -24.13 64.41 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.156 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.54 ' HA ' ' CD2' ' A' ' 43' ' ' PHE . 43.4 t -66.81 -54.86 18.2 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.659 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.57 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 96.7 mtp -73.26 -30.36 63.39 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.091 0.557 . . . . 0.0 112.218 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -74.0 -37.68 64.34 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 123.282 0.364 . . . . 0.0 111.693 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.4 m -85.91 -33.81 21.11 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 123.129 0.268 . . . . 0.0 111.436 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.496 ' HB3' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -87.02 -50.11 6.87 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 121.24 -0.184 . . . . 0.0 110.565 179.928 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.856 0 O-C-N 123.443 0.464 . . . . 0.0 112.547 -179.91 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.549 0.214 . . . . 0.0 111.119 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -104.85 -161.13 0.8 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.049 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 42.2 t 73.82 -47.26 0.65 Allowed 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.443 1.097 . . . . 0.0 111.826 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -98.78 -12.86 20.5 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 123.188 0.305 . . . . 0.0 111.571 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 5.8 mm-40 -97.85 147.9 33.71 Favored Pre-proline 0 CA--C 1.537 0.446 0 O-C-N 123.258 0.349 . . . . 0.0 111.04 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 3.7 Cg_exo -78.04 165.13 26.54 Favored 'Trans proline' 0 C--N 1.369 1.631 0 C-N-CA 123.264 2.643 . . . . 0.0 112.949 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.565 ' HD3' ' CD1' ' A' ' 20' ' ' PHE . 50.0 Cg_endo -60.48 161.1 21.58 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 123.492 2.795 . . . . 0.0 113.085 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.447 ' CE2' ' HD2' ' A' ' 37' ' ' ARG . 10.3 t80 -125.83 36.27 4.56 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.45 ' OG1' ' HD2' ' A' ' 31' ' ' PHE . 11.8 m -62.04 -47.79 83.16 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 178.688 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.37 -161.03 53.51 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.704 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.46 42.1 1.19 Allowed 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 123.067 2.511 . . . . 0.0 112.572 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.4 m -92.35 -66.12 0.95 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.466 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? 66.03 98.18 0.05 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.016 0.927 . . . . 0.0 111.571 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.544 ' HB1' HH21 ' A' ' 15' ' ' ARG . . . -119.03 -175.05 2.83 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.535 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.895 ' HE ' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -109.0 38.24 2.34 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.163 0.506 . . . . 0.0 111.866 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.419 ' C ' HG13 ' A' ' 32' ' ' VAL . 16.2 mt -138.52 71.41 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.384 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 1.062 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 13.1 tt -75.06 117.32 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-O 122.403 1.097 . . . . 0.0 111.48 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.761 ' N ' ' O ' ' A' ' 31' ' ' PHE . 54.4 mtt180 -100.28 -159.22 0.72 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 112.668 -2.06 . . . . 0.0 109.818 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.452 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 10.2 m-85 -125.5 164.23 20.95 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.736 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 7.1 p90 -158.13 164.31 36.74 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.894 -1.048 . . . . 0.0 108.994 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.632 ' HD1' ' SG ' ' A' ' 28' ' ' CYS . 63.1 t80 -108.9 110.28 21.56 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.641 HD21 ' HB2' ' A' ' 29' ' ' GLN . 0.2 OUTLIER -77.53 83.48 3.93 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.489 0.661 . . . . 0.0 109.916 -179.418 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 3' ' ' CYS . . . -62.31 -2.62 1.05 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.213 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -96.95 -38.07 9.95 Favored 'General case' 0 C--N 1.346 0.452 0 C-N-CA 122.359 0.263 . . . . 0.0 110.763 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -87.04 -56.01 3.57 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.016 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 153.56 -55.81 0.43 Allowed Glycine 0 C--N 1.343 0.929 0 C-N-CA 121.295 -0.478 . . . . 0.0 112.453 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 pp -96.74 -175.16 3.21 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -178.337 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.632 ' SG ' ' HD1' ' A' ' 21' ' ' TYR . 89.1 m -98.67 139.62 34.1 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.271 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.641 ' HB2' HD21 ' A' ' 22' ' ' ASN . 0.1 OUTLIER -123.38 153.64 40.09 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 123.263 0.352 . . . . 0.0 110.625 -179.713 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.674 ' HB ' HG12 ' A' ' 17' ' ' ILE . 40.4 p -85.36 120.0 26.35 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.761 ' O ' ' N ' ' A' ' 18' ' ' ARG . 4.1 p90 -108.77 163.3 13.39 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 114.263 -1.335 . . . . 0.0 107.421 177.284 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 1.062 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 41.0 t -104.39 144.25 14.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 119.546 1.066 . . . . 0.0 109.71 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.578 ' HB2' ' HD2' ' A' ' 18' ' ' ARG . 39.0 t80 -115.07 124.66 52.15 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.007 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -125.45 -168.29 12.69 Favored Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.581 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -97.28 23.9 33.79 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 121.353 -0.451 . . . . 0.0 112.936 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 21.6 p -95.5 -44.05 7.69 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.281 0.233 . . . . 0.0 111.055 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.447 ' HD2' ' CE2' ' A' ' 8' ' ' TYR . 40.2 mmt180 -133.4 169.68 16.59 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.897 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -158.66 120.96 3.6 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.031 0.532 . . . . 0.0 110.084 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -141.65 -169.1 2.82 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.326 0.584 . . . . 0.0 112.082 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -76.23 -67.61 0.67 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.93 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 57.6 t-20 -44.9 99.6 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -151.37 139.28 19.95 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.947 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.736 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 97.7 m-85 -142.71 147.71 36.09 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.588 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -96.71 -44.04 7.28 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.643 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.4 m -133.9 165.07 25.85 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.432 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -62.36 -69.58 0.25 Allowed 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.052 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 67.7 tt0 -51.52 -37.01 47.27 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.813 0.445 . . . . 0.0 111.283 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.409 ' HA ' ' HG2' ' A' ' 51' ' ' ARG . 1.4 m-20 -69.0 -34.0 74.56 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.462 178.247 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.662 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 33.8 t -65.93 -46.19 79.15 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.005 178.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.448 ' SD ' ' SG ' ' A' ' 28' ' ' CYS . 1.4 mpt? -64.75 -52.29 57.77 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.931 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 46.0 ptt85 -64.34 -37.16 86.53 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -178.853 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 25.5 m -80.38 -31.52 37.76 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.588 ' SG ' ' CD2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -88.41 -63.18 1.34 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 119.454 -0.307 . . . . 0.0 111.502 -179.616 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.455 ' N ' ' SG ' ' A' ' 53' ' ' CYS . . . . . . . . 0 C--N 1.347 1.148 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.553 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.476 0.179 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -96.14 7.74 45.62 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.028 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.535 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 46.9 t -84.05 -24.0 30.61 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.008 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.493 ' HA ' ' CB ' ' A' ' 23' ' ' ALA . 4.1 mm? -116.86 -12.53 10.75 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.651 0.594 . . . . 0.0 111.471 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.412 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 5.8 mm-40 -96.52 144.37 27.73 Favored Pre-proline 0 N--CA 1.468 0.43 0 O-C-N 123.287 0.367 . . . . 0.0 111.154 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 4.9 Cg_exo -78.7 163.18 26.67 Favored 'Trans proline' 0 C--N 1.369 1.642 0 C-N-CA 123.293 2.662 . . . . 0.0 113.052 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.513 ' HD3' ' CE1' ' A' ' 20' ' ' PHE . 62.6 Cg_endo -64.25 168.84 11.83 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 123.498 2.798 . . . . 0.0 113.084 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.537 ' CZ ' ' HD3' ' A' ' 37' ' ' ARG . 7.2 t80 -129.27 1.16 5.15 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.3 m -44.22 -13.05 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 49.46 -146.21 7.27 Favored Glycine 0 CA--C 1.535 1.327 0 N-CA-C 114.657 0.623 . . . . 0.0 114.657 177.67 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -83.43 4.72 6.84 Favored 'Trans proline' 0 C--N 1.37 1.698 0 C-N-CA 123.405 2.737 . . . . 0.0 113.487 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.4 136.61 33.79 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.1 82.74 2.04 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.867 -1.06 . . . . 0.0 109.798 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.6 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -78.57 -161.16 0.26 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.367 -1.288 . . . . 0.0 111.094 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.759 ' HE ' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -120.84 39.37 3.8 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.188 0.518 . . . . 0.0 111.358 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.551 ' HB ' ' O ' ' A' ' 33' ' ' TYR . 24.5 mt -134.97 75.66 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.061 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 1.08 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 21.2 mm -55.83 144.78 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 123.692 0.797 . . . . 0.0 110.837 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.53 HH12 ' HE3' ' A' ' 44' ' ' LYS . 14.4 mmt180 -149.11 171.63 16.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 113.679 -1.601 . . . . 0.0 110.166 -177.809 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.469 ' C ' ' HB2' ' A' ' 43' ' ' PHE . 4.3 m-85 -117.63 155.76 29.32 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 121.261 -0.176 . . . . 0.0 111.237 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.805 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 1.0 OUTLIER -146.68 152.86 39.55 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 123.643 0.589 . . . . 0.0 110.112 178.797 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.509 ' HB2' ' SG ' ' A' ' 49' ' ' CYS . 30.3 t80 -100.43 132.94 45.54 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.586 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -95.31 127.11 41.09 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.128 -0.694 . . . . 0.0 109.128 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 3' ' ' CYS . . . -94.59 14.15 21.87 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.603 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -97.03 -23.1 16.43 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.463 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -136.77 -23.25 1.2 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.264 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 97.69 -7.79 63.45 Favored Glycine 0 C--N 1.346 1.106 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.106 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.463 ' HG ' ' HB3' ' A' ' 25' ' ' ALA . 3.4 pp -87.31 144.8 26.62 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 122.757 0.423 . . . . 0.0 111.759 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.479 ' H ' ' HE1' ' A' ' 50' ' ' MET . 78.3 m -92.19 142.3 27.64 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.832 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.538 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 2.5 tm0? -124.22 145.58 49.26 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.185 0.516 . . . . 0.0 111.835 -178.056 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.413 HG22 ' CZ ' ' A' ' 19' ' ' TYR . 39.8 p -85.4 143.11 28.81 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.509 -1.223 . . . . 0.0 111.826 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.559 ' CZ ' ' HB3' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -165.13 176.13 8.76 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.9 178.343 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 1.08 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 1.3 t -92.77 -162.07 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 124.32 1.048 . . . . 0.0 111.141 -178.791 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.749 ' H ' HG12 ' A' ' 32' ' ' VAL . 65.4 t80 -174.33 144.15 0.91 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.631 1.173 . . . . 0.0 109.037 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.89 -160.55 9.59 Favored Glycine 0 C--N 1.337 0.602 0 C-N-CA 120.962 -0.637 . . . . 0.0 113.225 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -94.77 15.05 64.18 Favored Glycine 0 C--N 1.338 0.693 0 O-C-N 123.781 0.342 . . . . 0.0 113.406 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -48.03 7.47 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.537 ' HD3' ' CZ ' ' A' ' 8' ' ' TYR . 2.6 mmp_? -135.49 119.54 17.55 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.021 0.439 . . . . 0.0 111.498 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -118.46 119.38 34.4 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.635 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.405 ' HB3' ' H ' ' A' ' 40' ' ' ARG . 9.8 tmtt? -124.43 -114.87 0.29 Allowed 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.824 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.405 ' H ' ' HB3' ' A' ' 39' ' ' LYS . 24.4 mmm180 -142.39 -33.37 0.48 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 122.657 0.383 . . . . 0.0 111.306 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -66.62 101.38 0.78 Allowed 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.696 0.76 . . . . 0.0 111.45 -179.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -146.38 150.57 35.93 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 114.343 -1.299 . . . . 0.0 109.61 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.805 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 64.6 m-85 -153.36 165.35 36.05 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.811 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.53 ' HE3' HH12 ' A' ' 18' ' ' ARG . 13.8 mptt -99.02 -54.82 2.88 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.701 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.6 m -143.71 170.6 15.56 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.724 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.87 -46.79 87.9 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -52.17 -60.57 3.05 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.069 0.548 . . . . 0.0 110.941 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 52' ' ' THR . 49.0 m-20 -59.55 -53.44 58.11 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.316 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.632 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 28.5 t -40.28 -48.25 2.6 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.546 0.738 . . . . 0.0 111.961 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.479 ' HE1' ' H ' ' A' ' 28' ' ' CYS . 25.6 mmt -67.59 -47.11 70.68 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.854 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -79.3 -9.55 59.61 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 48' ' ' ASP . 40.2 m -91.67 -45.38 8.49 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.264 0.225 . . . . 0.0 110.586 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.64 -43.72 8.16 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 123.159 0.287 . . . . 0.0 110.802 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.043 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.716 179.968 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 120.55 0.214 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -124.91 -167.22 1.64 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.17 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 21' ' ' TYR . 6.6 t 72.1 -36.24 0.35 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.728 1.211 . . . . 0.0 112.552 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.496 ' CD1' ' HB2' ' A' ' 23' ' ' ALA . 13.7 tp -80.05 -10.4 59.77 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 123.419 0.45 . . . . 0.0 111.844 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -95.75 152.59 39.18 Favored Pre-proline 0 CA--C 1.536 0.435 0 O-C-N 123.395 0.435 . . . . 0.0 110.374 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.92 149.46 90.13 Favored 'Trans proline' 0 C--N 1.368 1.602 0 C-N-CA 122.603 2.202 . . . . 0.0 113.166 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.466 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 31.1 Cg_endo -55.71 138.21 80.57 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 123.648 2.899 . . . . 0.0 113.476 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.571 ' O ' ' N ' ' A' ' 10' ' ' GLY . 1.6 t80 -91.18 8.11 37.36 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.568 0.543 . . . . 0.0 111.861 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 32' ' ' VAL . 10.6 m -30.04 -18.99 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 -178.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.571 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 5.86 110.91 0.0 OUTLIER Glycine 0 C--N 1.358 1.762 0 CA-C-O 118.41 -1.217 . . . . 0.0 114.488 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -23.06 87.1 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 124.953 3.769 . . . . 0.0 115.559 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.9 m -129.9 -157.49 0.82 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.283 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -98.6 71.61 1.98 Allowed 'General case' 0 C--O 1.239 0.543 0 CA-C-O 122.209 1.004 . . . . 0.0 108.318 178.753 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.664 ' HB1' HG12 ' A' ' 32' ' ' VAL . . . -100.16 128.02 46.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 113.688 -1.596 . . . . 0.0 111.82 -179.166 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.74 20.78 2.34 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.832 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.2 mt -137.21 105.1 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.877 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.909 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 9.1 tt -81.44 134.72 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 121.545 0.688 . . . . 0.0 110.26 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.814 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 57.7 mtt180 -128.44 -176.92 3.97 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.864 -1.516 . . . . 0.0 111.105 -177.597 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.551 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.8 m-85 -122.83 148.55 45.26 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.299 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.466 ' CE2' ' HD3' ' A' ' 7' ' ' PRO . 8.9 p90 -144.3 150.6 38.12 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.357 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.652 ' HE1' ' HA2' ' A' ' 26' ' ' GLY . 3.7 t80 -86.56 125.3 33.69 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -97.4 121.94 39.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.496 ' HB2' ' CD1' ' A' ' 4' ' ' LEU . . . -80.36 5.26 15.39 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.195 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -96.55 -16.57 21.0 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.873 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.09 -39.36 1.74 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.106 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.652 ' HA2' ' HE1' ' A' ' 21' ' ' TYR . . . 114.12 -42.4 1.94 Allowed Glycine 0 C--N 1.343 0.934 0 C-N-CA 121.416 -0.421 . . . . 0.0 112.317 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.737 HD23 ' H ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -77.1 169.6 18.04 Favored 'General case' 0 C--O 1.243 0.754 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -179.127 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 62.7 m -96.05 136.14 36.9 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.167 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.551 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 18.5 mt-30 -106.15 156.17 18.71 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 123.746 0.654 . . . . 0.0 111.652 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.523 HG22 ' CE1' ' A' ' 19' ' ' TYR . 47.8 p -92.26 129.44 38.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.398 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.474 ' C ' HG13 ' A' ' 17' ' ' ILE . 3.1 p90 -142.83 138.76 30.56 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.423 -0.808 . . . . 0.0 108.968 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.909 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 26.0 t -88.7 103.79 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 122.889 0.475 . . . . 0.0 111.74 -178.522 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -68.08 146.19 53.71 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.367 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -120.31 153.24 16.76 Favored Glycine 0 C--N 1.336 0.556 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.01 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -98.79 44.64 1.7 Allowed Glycine 0 C--N 1.336 0.575 0 C-N-CA 121.254 -0.498 . . . . 0.0 113.103 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.5 p -95.7 -36.18 11.29 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.434 ' O ' ' HB3' ' A' ' 38' ' ' ALA . 88.4 mtt-85 -128.17 -67.57 0.8 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 123.311 0.382 . . . . 0.0 111.394 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 37' ' ' ARG . . . 96.36 132.91 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.093 1.357 . . . . 0.0 110.056 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -129.16 -112.17 0.27 Allowed 'General case' 0 CA--C 1.548 0.897 0 O-C-N 123.563 0.539 . . . . 0.0 111.772 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -151.67 -35.42 0.13 Allowed 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 64.5 t-20 -76.96 94.71 4.0 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.814 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 6.5 m-80 -157.86 125.01 5.05 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.501 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.546 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 82.1 m-85 -132.51 101.54 5.36 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -65.51 -13.29 58.57 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.3 m -131.07 140.3 50.02 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.638 0.256 . . . . 0.0 111.271 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.74 -48.0 76.2 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.13 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -47.72 -59.16 3.5 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 124.008 0.818 . . . . 0.0 110.281 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -63.68 -36.74 84.86 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.625 0.37 . . . . 0.0 111.18 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.705 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 51.0 t -56.41 -60.48 3.46 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 123.594 0.558 . . . . 0.0 110.758 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.0 mtt -63.56 -36.89 85.3 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.5 ttt85 -67.39 -38.46 84.74 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 16.9 m -79.07 -49.72 12.21 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 122.879 0.112 . . . . 0.0 111.084 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.705 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -80.92 -58.59 3.02 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.653 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.107 0 C-N-CA 120.906 -0.664 . . . . 0.0 113.23 -179.598 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.503 0.192 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -123.64 -148.44 0.4 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.197 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.494 ' SG ' ' HB3' ' A' ' 21' ' ' TYR . 34.0 t 70.45 -14.06 0.43 Allowed 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 124.299 1.039 . . . . 0.0 112.638 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.499 HD13 ' CE2' ' A' ' 21' ' ' TYR . 19.1 tp -92.93 42.7 1.11 Allowed 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.533 0.682 . . . . 0.0 111.088 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.45 ' HB3' ' NZ ' ' A' ' 39' ' ' LYS . 61.1 mp0 -129.98 144.92 55.03 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.966 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -71.45 153.88 60.68 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 122.887 2.391 . . . . 0.0 112.804 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.442 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 36.4 Cg_endo -57.83 133.7 57.82 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 123.458 2.772 . . . . 0.0 113.265 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -105.17 13.27 30.92 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.01 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 12' ' ' CYS . 7.1 m -46.01 -24.15 0.39 Allowed 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.412 0.685 . . . . 0.0 112.702 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 53.47 -141.53 30.98 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-O 119.482 -0.621 . . . . 0.0 114.351 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.489 ' HD2' ' HE ' ' A' ' 37' ' ' ARG . 6.3 Cg_exo -79.25 -4.48 13.79 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 123.296 2.664 . . . . 0.0 113.218 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.522 ' O ' HG22 ' A' ' 9' ' ' THR . 0.1 OUTLIER -86.01 141.27 29.61 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 179.712 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.01 85.93 2.21 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.647 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.433 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -78.01 -167.51 1.03 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 114.569 -1.196 . . . . 0.0 111.498 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.755 ' HD3' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -119.43 34.34 5.26 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 121.178 0.513 . . . . 0.0 111.45 -179.073 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.3 mt -132.29 78.36 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.44 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 1.045 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.0 mp -65.28 145.9 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-O 121.454 0.645 . . . . 0.0 109.669 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.711 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 65.4 mtt180 -148.19 168.81 21.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.726 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.534 ' CE1' HG22 ' A' ' 30' ' ' THR . 1.6 m-85 -112.85 148.4 34.98 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.596 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 4.8 p90 -141.49 152.77 44.47 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.449 1.093 . . . . 0.0 109.435 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.551 ' HE1' ' HA2' ' A' ' 26' ' ' GLY . 7.5 t80 -83.68 144.45 29.38 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -123.07 122.38 38.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.474 ' HB2' HD11 ' A' ' 4' ' ' LEU . . . -79.75 10.57 3.94 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.686 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -96.56 -22.25 17.18 Favored 'General case' 0 C--N 1.346 0.444 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.52 ' O ' HD23 ' A' ' 27' ' ' LEU . . . -133.0 -11.6 2.93 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.075 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.551 ' HA2' ' HE1' ' A' ' 21' ' ' TYR . . . 86.8 -39.63 3.09 Favored Glycine 0 C--N 1.345 1.047 0 C-N-CA 121.555 -0.355 . . . . 0.0 113.291 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.604 HD23 ' H ' ' A' ' 27' ' ' LEU . 0.4 OUTLIER -76.51 178.25 6.78 Favored 'General case' 0 C--O 1.244 0.8 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.3 m -102.27 151.01 22.73 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.985 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.596 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 53.7 tp60 -116.45 158.62 23.26 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.716 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.534 HG22 ' CE1' ' A' ' 19' ' ' TYR . 39.9 p -94.0 126.49 39.25 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.791 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.593 ' O ' ' N ' ' A' ' 18' ' ' ARG . 2.7 p90 -145.18 140.29 27.82 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.055 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 1.045 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -89.08 101.26 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 C-N-CA 123.45 0.7 . . . . 0.0 112.526 -178.167 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -73.71 148.54 42.57 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.234 178.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -140.78 -172.97 13.23 Favored Glycine 0 C--N 1.338 0.641 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.34 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -94.5 1.58 66.68 Favored Glycine 0 C--N 1.34 0.767 0 O-C-N 123.767 0.334 . . . . 0.0 113.266 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -37.71 19.28 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.489 ' HE ' ' HD2' ' A' ' 11' ' ' PRO . 88.6 mtt-85 -137.05 111.85 8.82 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.936 0.398 . . . . 0.0 111.101 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -93.85 144.01 25.82 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.918 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.45 ' NZ ' ' HB3' ' A' ' 5' ' ' GLU . 4.6 tmtp? -134.78 -128.04 0.16 Allowed 'General case' 0 CA--C 1.55 0.946 0 O-C-N 123.464 0.477 . . . . 0.0 110.744 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 78.2 mtm180 -144.28 -32.38 0.43 Allowed 'General case' 0 C--N 1.351 0.667 0 CA-C-N 118.185 0.448 . . . . 0.0 112.146 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -89.43 102.02 14.7 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.416 0.627 . . . . 0.0 111.363 -179.066 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.711 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 69.7 m-80 -144.64 116.92 8.46 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.862 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.431 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 70.3 m-85 -138.79 108.06 6.1 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.528 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -62.97 -16.81 60.9 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 60.0 p -130.98 136.68 48.76 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 120.731 0.3 . . . . 0.0 111.28 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.437 ' HB2' ' CE2' ' A' ' 19' ' ' TYR . . . -60.83 -43.12 98.69 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.444 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -48.6 -61.75 1.86 Allowed 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.857 0.723 . . . . 0.0 110.908 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -61.8 -38.24 87.38 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 122.433 0.293 . . . . 0.0 111.176 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.489 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 47.0 t -54.49 -60.04 3.88 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 123.653 0.596 . . . . 0.0 110.754 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 68.4 mtt -60.98 -40.5 93.69 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.061 0.545 . . . . 0.0 112.103 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -65.23 -30.72 71.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.407 HG21 ' HZ ' ' A' ' 43' ' ' PHE . 21.3 m -82.46 -50.3 9.01 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 122.921 0.138 . . . . 0.0 110.848 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -86.98 -58.98 2.39 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.869 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.464 -179.761 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 45.4 p30 . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 120.493 0.187 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -124.33 175.01 7.35 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.402 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.574 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 11.7 t 70.5 -15.67 0.35 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 124.48 1.112 . . . . 0.0 113.193 179.419 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.5 -14.25 59.0 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -100.41 155.66 36.12 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.198 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.21 165.28 5.61 Favored 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 122.809 2.339 . . . . 0.0 112.827 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.571 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 28.9 Cg_endo -55.3 134.17 62.29 Favored 'Trans proline' 0 C--N 1.376 1.98 0 C-N-CA 123.318 2.679 . . . . 0.0 113.172 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.563 ' HD2' ' HB3' ' A' ' 39' ' ' LYS . 3.6 t80 -87.1 22.02 2.18 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 123.505 0.503 . . . . 0.0 112.057 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.645 HG23 HG12 ' A' ' 32' ' ' VAL . 20.2 m -50.17 -31.38 13.48 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.076 0.55 . . . . 0.0 111.287 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 37.87 -133.29 1.25 Allowed Glycine 0 C--N 1.352 1.454 0 O-C-N 124.126 0.891 . . . . 0.0 114.026 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -83.32 3.93 7.41 Favored 'Trans proline' 0 C--N 1.366 1.486 0 C-N-CA 123.062 2.508 . . . . 0.0 112.51 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.7 m -97.27 140.96 30.97 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.16 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -148.58 85.87 1.51 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.261 0.553 . . . . 0.0 110.444 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.421 ' O ' HG21 ' A' ' 32' ' ' VAL . . . -91.36 -171.4 2.93 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.999 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.19 35.82 3.13 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.158 0.504 . . . . 0.0 112.035 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 17.4 mt -135.11 95.01 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.566 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 1.042 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.9 mp -93.87 138.86 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 121.74 0.781 . . . . 0.0 110.017 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.796 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 31.6 mtt180 -127.38 -153.19 0.55 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 113.497 -1.683 . . . . 0.0 109.546 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 3.4 m-85 -116.4 170.7 8.35 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.509 0.595 . . . . 0.0 112.262 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.646 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 9.3 p90 -159.52 167.76 27.82 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.571 1.169 . . . . 0.0 110.362 176.5 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.612 ' CD2' ' HB2' ' A' ' 53' ' ' CYS . 5.2 t80 -106.65 102.05 11.46 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.43 86.48 3.81 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.717 0.77 . . . . 0.0 109.095 178.616 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.432 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . . . -71.12 0.73 7.03 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.605 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.8 ttpt -95.02 -34.15 12.45 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.32 -49.01 6.16 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.17 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 145.38 -57.76 0.52 Allowed Glycine 0 C--N 1.343 0.963 0 O-C-N 123.452 0.47 . . . . 0.0 112.853 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 pp -89.88 -175.4 4.59 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.3 m -99.59 136.76 39.05 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.666 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.646 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 20.9 tt0 -111.05 -151.29 0.48 Allowed 'General case' 0 C--O 1.243 0.744 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.612 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 19' ' ' TYR . 34.1 p -138.69 135.35 34.72 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-N 118.789 0.722 . . . . 0.0 111.468 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.719 ' O ' ' N ' ' A' ' 18' ' ' ARG . 1.3 p90 -133.87 165.55 24.73 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.777 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 1.042 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.2 p -78.16 -163.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 C-N-CA 123.398 0.679 . . . . 0.0 111.533 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.724 ' H ' HG22 ' A' ' 32' ' ' VAL . 64.7 t80 -169.31 113.37 0.53 Allowed 'General case' 0 C--O 1.238 0.45 0 C-N-CA 124.145 0.978 . . . . 0.0 108.983 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -117.87 160.65 13.66 Favored Glycine 0 C--N 1.334 0.424 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.585 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -88.25 44.75 3.22 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 121.487 -0.387 . . . . 0.0 112.368 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.5 p -95.27 -49.15 5.6 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.478 0.311 . . . . 0.0 111.207 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -130.99 -37.34 1.29 Allowed 'General case' 0 N--CA 1.467 0.42 0 O-C-N 123.288 0.368 . . . . 0.0 111.485 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 53.86 113.65 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.123 0.969 . . . . 0.0 112.861 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.563 ' HB3' ' HD2' ' A' ' 8' ' ' TYR . 5.0 pttt -124.75 166.13 16.73 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.804 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -83.34 57.45 4.0 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 60.1 t-20 -148.58 92.82 2.05 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.664 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.796 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 7.4 m-80 -156.9 143.97 18.69 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.2 178.498 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.483 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 31.3 m-85 -136.65 147.21 46.74 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -96.76 -43.38 7.55 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.576 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.6 m -127.46 158.63 36.86 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.393 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.44 -59.6 3.83 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.778 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -48.62 -39.96 25.93 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.317 0.647 . . . . 0.0 111.64 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -74.43 -34.87 63.34 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.997 178.228 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.483 ' HA ' ' CD2' ' A' ' 43' ' ' PHE . 45.2 t -67.75 -23.74 65.27 Favored 'General case' 0 C--N 1.349 0.556 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.692 177.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.621 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 94.3 mtp -83.71 -51.86 6.9 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -49.18 -38.47 25.95 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.057 179.058 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.2 m -92.5 -49.78 5.95 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.187 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.612 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 1.6 p -128.34 65.25 1.4 Allowed 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.621 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.337 0.614 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.438 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.583 0.23 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -119.65 175.5 5.83 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.361 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 43' ' ' PHE . 22.9 t 71.6 -37.31 0.39 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.647 1.179 . . . . 0.0 112.955 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 mp -82.71 -10.61 58.83 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -90.72 157.04 44.46 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.659 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -57.8 143.19 96.01 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.79 2.327 . . . . 0.0 113.181 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.54 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 39.8 Cg_endo -59.14 128.6 28.26 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 123.468 2.779 . . . . 0.0 113.824 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.653 ' HE2' ' HD3' ' A' ' 37' ' ' ARG . 81.4 t80 -129.6 100.93 5.7 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.738 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.483 HG23 ' N ' ' A' ' 34' ' ' GLY . 90.3 m -96.6 -79.65 0.45 Allowed 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.71 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.414 ' HA2' ' HD3' ' A' ' 11' ' ' PRO . . . 128.57 131.79 3.46 Favored Glycine 0 C--N 1.338 0.652 0 CA-C-O 118.83 -0.983 . . . . 0.0 110.666 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.414 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 15.1 Cg_exo -68.89 72.3 1.05 Allowed 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.704 2.27 . . . . 0.0 112.608 -179.141 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 51.2 m -126.02 -107.66 0.32 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.042 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -132.0 73.25 1.52 Allowed 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.444 0.64 . . . . 0.0 109.986 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.525 ' HB1' HG12 ' A' ' 32' ' ' VAL . . . -97.75 116.59 30.27 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.638 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -139.3 33.31 2.09 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.836 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 43.1 mt -138.46 121.35 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.362 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.654 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.1 mp -95.47 144.6 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.863 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 57.4 mtt180 -143.86 -174.74 4.34 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.492 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.592 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.1 m-85 -114.63 146.14 41.18 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.985 0.422 . . . . 0.0 112.051 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.61 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 4.0 p90 -139.76 153.96 47.28 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.023 -0.99 . . . . 0.0 108.731 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.501 ' CZ ' ' HA2' ' A' ' 26' ' ' GLY . 63.0 t80 -98.74 135.18 40.59 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -101.09 139.65 36.47 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 176.205 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -96.19 2.87 53.4 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.811 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.6 tttm -99.1 -38.1 9.07 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.53 -25.46 12.76 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.879 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.501 ' HA2' ' CZ ' ' A' ' 21' ' ' TYR . . . 67.02 53.18 28.01 Favored Glycine 0 C--N 1.348 1.244 0 C-N-CA 121.341 -0.457 . . . . 0.0 112.637 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 pp -153.17 164.71 37.57 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 122.688 0.395 . . . . 0.0 111.012 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 92.3 m -99.51 109.2 21.76 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.15 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.592 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -97.64 157.64 15.93 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.708 -178.852 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.519 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 34.6 p -87.78 130.09 34.97 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.517 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.61 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 7.5 p90 -152.36 152.64 32.32 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.214 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.654 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.1 t -77.44 161.38 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 C-N-CA 123.628 0.771 . . . . 0.0 112.545 -177.898 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.648 ' OH ' ' HB1' ' A' ' 38' ' ' ALA . 12.3 t80 -132.1 143.1 49.77 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.571 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.483 ' N ' HG23 ' A' ' 9' ' ' THR . . . -100.09 -161.1 28.47 Favored Glycine 0 C--N 1.337 0.597 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.113 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -144.06 3.26 1.47 Allowed Glycine 0 C--N 1.341 0.818 0 C-N-CA 121.139 -0.553 . . . . 0.0 114.094 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 25.7 p -84.24 -53.5 5.45 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.461 0.63 . . . . 0.0 110.534 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.653 ' HD3' ' HE2' ' A' ' 8' ' ' TYR . 54.7 ttt-85 -102.54 -84.54 0.45 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 177.583 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.648 ' HB1' ' OH ' ' A' ' 33' ' ' TYR . . . 81.91 126.18 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.347 1.059 . . . . 0.0 112.173 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -112.36 -178.12 3.33 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.616 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 88.4 mtm180 -91.92 6.47 46.09 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.474 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.459 ' OD1' ' HA ' ' A' ' 3' ' ' CYS . 52.5 t-20 -96.5 76.51 2.9 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.032 0.444 . . . . 0.0 110.769 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.863 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 7.7 m120 -156.94 134.23 10.54 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.199 178.571 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.569 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 32.4 m-85 -134.24 105.5 6.67 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.293 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -73.27 -4.61 34.2 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.9 m -131.15 135.05 47.12 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 120.753 0.311 . . . . 0.0 111.512 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.52 -43.52 84.99 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.411 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -50.91 -56.19 13.54 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 123.667 0.605 . . . . 0.0 111.279 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -64.91 -48.93 72.39 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 116.682 -0.236 . . . . 0.0 110.443 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.568 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 43.1 t -48.02 -47.15 33.64 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 123.729 0.643 . . . . 0.0 111.336 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.19 -42.74 71.97 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.311 0.244 . . . . 0.0 111.405 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -69.5 -15.05 63.18 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.6 m -107.38 -51.88 2.85 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 122.952 0.158 . . . . 0.0 111.297 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.568 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.8 OUTLIER -111.11 18.33 19.5 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -178.967 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.798 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.478 178.681 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.511 0.196 . . . . 0.0 111.158 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.551 ' CD2' ' HB3' ' A' ' 40' ' ' ARG . 3.7 p90 -111.18 149.27 31.17 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.125 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.5 t 175.35 -39.52 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.255 0.622 . . . . 0.0 110.864 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.464 ' HG ' ' CB ' ' A' ' 23' ' ' ALA . 6.1 mp -87.43 17.78 4.28 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 123.402 0.439 . . . . 0.0 111.862 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.464 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 5.8 mm-40 -96.16 122.52 57.81 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.077 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 2.8 Cg_exo -76.71 165.62 28.45 Favored 'Trans proline' 0 C--N 1.368 1.577 0 C-N-CA 123.062 2.508 . . . . 0.0 112.558 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.595 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 28.3 Cg_endo -55.08 135.63 69.63 Favored 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 123.372 2.715 . . . . 0.0 113.386 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.407 ' C ' ' H ' ' A' ' 10' ' ' GLY . 2.7 t80 -95.95 28.67 3.03 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.972 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.646 HG23 HG11 ' A' ' 32' ' ' VAL . 14.1 m -49.65 -4.86 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . -27.09 131.35 0.04 OUTLIER Glycine 0 N--CA 1.477 1.399 0 CA-C-O 118.219 -1.323 . . . . 0.0 112.42 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -16.91 77.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.076 1 C-N-CA 125.664 4.243 . . . . 0.0 116.013 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.6 m -134.09 176.52 8.51 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.358 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -87.27 55.44 3.54 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.891 0.853 . . . . 0.0 109.941 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.65 ' HA ' ' HA2' ' A' ' 34' ' ' GLY . . . -80.95 113.44 19.16 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.857 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.689 ' O ' HG13 ' A' ' 16' ' ' ILE . 5.8 tpm_? -133.71 33.33 3.49 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.723 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.689 HG13 ' O ' ' A' ' 15' ' ' ARG . 31.4 mt -154.94 113.83 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.43 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 1.048 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.8 mp -91.42 115.63 30.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 122.312 1.053 . . . . 0.0 109.902 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.734 ' N ' ' O ' ' A' ' 31' ' ' PHE . 2.2 mmp_? -100.8 -156.12 0.54 Allowed 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 112.428 -2.169 . . . . 0.0 110.081 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 4.8 m-85 -123.75 166.7 15.11 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.822 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 8.4 p90 -162.91 170.96 17.34 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.168 176.337 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.633 ' HB2' ' SG ' ' A' ' 49' ' ' CYS . 0.8 OUTLIER -115.74 107.91 15.67 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.479 0.312 . . . . 0.0 111.408 -178.852 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.5 ' C ' ' H ' ' A' ' 24' ' ' LYS . 24.0 m120 -76.49 97.55 4.36 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-O 121.451 0.643 . . . . 0.0 112.064 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.464 ' CB ' ' HG ' ' A' ' 4' ' ' LEU . . . -76.62 24.07 0.15 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.881 177.912 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.5 ' H ' ' C ' ' A' ' 22' ' ' ASN . 12.7 tmtt? -98.73 -39.95 8.39 Favored 'General case' 0 C--N 1.35 0.624 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 177.466 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 -51.75 2.84 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.422 -1.263 . . . . 0.0 109.988 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.2 -35.18 1.59 Allowed Glycine 0 C--N 1.348 1.247 0 C-N-CA 121.246 -0.502 . . . . 0.0 112.972 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 pp -87.68 169.28 12.26 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 94.7 m -98.84 139.91 33.81 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.386 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -132.73 158.76 41.57 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 123.466 0.479 . . . . 0.0 110.98 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 19' ' ' TYR . 45.1 p -85.65 121.44 28.33 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.412 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.734 ' O ' ' N ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -113.54 178.81 4.15 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 176.682 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 1.048 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.3 p -91.4 -159.16 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 118.794 0.724 . . . . 0.0 110.897 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.785 ' H ' HG22 ' A' ' 32' ' ' VAL . 77.2 t80 -173.49 111.34 0.19 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.514 1.125 . . . . 0.0 108.564 177.914 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.65 ' HA2' ' HA ' ' A' ' 14' ' ' ALA . . . -92.59 163.26 27.2 Favored Glycine 0 C--N 1.336 0.571 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.743 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.31 26.42 11.83 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 121.372 -0.442 . . . . 0.0 113.133 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -95.59 -51.02 4.71 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 122.185 0.194 . . . . 0.0 111.072 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 -145.18 139.8 27.49 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.317 0.385 . . . . 0.0 111.441 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -99.69 118.63 36.61 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.769 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.76 -171.46 2.06 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.236 0.541 . . . . 0.0 111.078 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.551 ' HB3' ' CD2' ' A' ' 2' ' ' PHE . 40.1 mmt180 -82.38 -74.5 0.34 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.428 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.464 ' HB2' ' HB2' ' A' ' 5' ' ' GLU . 49.6 t-20 -51.71 101.94 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -148.67 136.19 20.46 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 114.022 -1.445 . . . . 0.0 109.311 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.822 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 59.4 m-85 -138.17 150.07 46.44 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.572 ' HG3' ' NH1' ' A' ' 18' ' ' ARG . 0.7 OUTLIER -97.23 -46.02 6.29 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 114.684 -1.144 . . . . 0.0 111.922 -179.594 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.496 ' HB2' ' OD2' ' A' ' 48' ' ' ASP . 52.9 m -133.3 168.09 19.21 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.199 0.312 . . . . 0.0 111.603 -179.174 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.439 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -63.25 -64.69 0.83 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.875 0.47 . . . . 0.0 111.814 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.474 ' O ' ' HD2' ' A' ' 51' ' ' ARG . 97.9 mt-10 -53.17 -34.75 58.23 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.809 0.444 . . . . 0.0 111.836 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.496 ' OD2' ' HB2' ' A' ' 45' ' ' SER . 54.8 m-20 -73.52 -33.32 64.7 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.269 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.661 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 33.9 t -63.84 -47.55 80.32 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.914 178.454 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.413 ' HB3' ' NH2' ' A' ' 51' ' ' ARG . 74.7 mtm -69.6 -48.22 60.87 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.478 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.474 ' HD2' ' O ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -64.17 -30.41 71.47 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.421 ' HB ' ' HE1' ' A' ' 43' ' ' PHE . 31.0 m -90.69 -32.0 16.36 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.48 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.56 ' HB3' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -80.85 -51.95 8.03 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 117.856 0.298 . . . . 0.0 111.008 -179.782 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 0.983 0 C-N-CA 121.358 -0.449 . . . . 0.0 112.61 -179.707 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.598 0.237 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -138.52 -32.22 0.71 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.397 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.9 t -77.25 -20.3 55.37 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.855 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.0 pp -88.05 23.78 2.0 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 120.952 0.406 . . . . 0.0 111.874 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -96.01 155.31 38.42 Favored Pre-proline 0 CA--C 1.537 0.447 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.784 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.3 141.45 81.94 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.675 2.25 . . . . 0.0 113.452 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.527 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 29.1 Cg_endo -54.81 133.87 59.86 Favored 'Trans proline' 0 C--N 1.372 1.766 0 C-N-CA 123.968 3.112 . . . . 0.0 114.029 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -135.54 103.53 5.49 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.592 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.678 HG23 ' HA ' ' A' ' 33' ' ' TYR . 28.5 m -96.49 -78.06 0.47 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.26 146.81 9.38 Favored Glycine 0 C--N 1.342 0.898 0 CA-C-O 119.117 -0.824 . . . . 0.0 111.636 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.515 ' HD2' HH22 ' A' ' 37' ' ' ARG . 7.9 Cg_exo -72.35 68.9 3.4 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.882 2.388 . . . . 0.0 112.247 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.9 m -124.9 -152.8 0.53 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.827 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -87.25 57.65 4.58 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.834 0.826 . . . . 0.0 110.182 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.622 ' HA ' ' HA2' ' A' ' 34' ' ' GLY . . . -85.26 116.17 23.45 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.697 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.502 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 3.4 ppt_? -142.16 21.77 2.08 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.046 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.5 mt -131.96 116.05 29.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.223 -178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.863 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.7 mp -92.83 106.68 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 122.267 1.032 . . . . 0.0 109.355 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.617 ' N ' ' O ' ' A' ' 31' ' ' PHE . 51.2 mtt180 -98.2 174.58 6.44 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 112.825 -1.989 . . . . 0.0 110.955 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.53 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 1.5 m-85 -110.73 152.11 26.96 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.625 0.25 . . . . 0.0 111.093 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.587 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 2.4 p90 -139.83 157.46 45.68 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.592 ' CZ ' ' HA2' ' A' ' 26' ' ' GLY . 80.9 t80 -90.71 129.83 36.76 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.734 0.302 . . . . 0.0 111.366 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.612 ' HB2' HD13 ' A' ' 27' ' ' LEU . 3.2 m120 -96.58 127.66 42.77 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.31 11.79 20.24 Favored 'General case' 0 C--O 1.239 0.526 0 O-C-N 123.416 0.447 . . . . 0.0 111.981 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -97.42 -25.04 15.34 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.651 0.262 . . . . 0.0 110.916 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.894 ' HB3' HD12 ' A' ' 27' ' ' LEU . . . -138.38 -27.37 0.87 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.731 -178.719 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.592 ' HA2' ' CZ ' ' A' ' 21' ' ' TYR . . . 99.09 8.66 53.45 Favored Glycine 0 C--N 1.344 1.009 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.944 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.894 HD12 ' HB3' ' A' ' 25' ' ' ALA . 0.0 OUTLIER -96.51 151.21 19.79 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.581 0.229 . . . . 0.0 111.344 -179.634 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 87.3 m -93.56 110.26 21.85 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.36 178.733 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.587 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 33.1 tt0 -88.0 159.14 18.42 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.048 -177.549 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.44 HG22 ' CE1' ' A' ' 19' ' ' TYR . 35.5 p -96.32 128.69 43.48 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.442 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.617 ' O ' ' N ' ' A' ' 18' ' ' ARG . 7.7 p90 -152.2 152.22 31.97 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.643 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.863 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -78.33 174.28 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 C-N-CA 123.491 0.717 . . . . 0.0 111.982 -177.824 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.678 ' HA ' HG23 ' A' ' 9' ' ' THR . 48.0 t80 -155.99 139.5 15.89 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.352 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.622 ' HA2' ' HA ' ' A' ' 14' ' ' ALA . . . -102.59 -55.0 0.85 Allowed Glycine 0 C--N 1.338 0.685 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.187 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 98.36 27.37 8.7 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.527 -0.368 . . . . 0.0 113.319 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.6 p -95.79 -43.07 8.03 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.28 0.232 . . . . 0.0 111.545 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.515 HH22 ' HD2' ' A' ' 11' ' ' PRO . 84.4 mtm-85 -116.03 8.87 14.68 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 123.357 0.411 . . . . 0.0 111.644 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 12.2 118.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -92.7 -124.69 0.09 Allowed 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.721 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -140.46 -34.74 0.52 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 118.35 0.523 . . . . 0.0 111.47 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 63.5 t-20 -83.81 96.92 8.91 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.004 0.43 . . . . 0.0 111.789 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.582 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 6.4 m-80 -154.92 118.48 4.53 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.271 177.803 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.53 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 28.8 m-85 -137.96 105.69 5.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.726 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -76.36 2.45 13.45 Favored 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.5 m -135.77 132.12 36.37 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.222 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.69 -45.48 89.84 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.392 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -48.39 -55.25 11.28 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.426 0.69 . . . . 0.0 111.516 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -66.15 -45.63 80.32 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 122.449 0.3 . . . . 0.0 110.749 178.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.425 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 44.7 t -47.06 -50.38 19.75 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 123.803 0.689 . . . . 0.0 111.393 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 94.9 mtp -77.38 -35.72 54.14 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.638 0.375 . . . . 0.0 111.973 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -62.47 -28.69 69.99 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 9.8 m -104.09 -52.19 2.99 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 123.196 0.31 . . . . 0.0 110.944 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.425 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -99.45 19.71 15.12 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.31 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.874 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.433 178.661 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 1' ' ' ASP . . . . . 0.534 ' N ' HH22 ' A' ' 40' ' ' ARG . 47.1 t0 . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.521 0.2 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.421 ' HD1' ' SG ' ' A' ' 3' ' ' CYS . 12.3 p90 -130.94 -171.19 2.51 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.936 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 67.8 m 72.54 -51.56 0.7 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.379 1.071 . . . . 0.0 112.698 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 57.6 mt -79.35 -11.96 59.93 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -95.04 146.49 31.41 Favored Pre-proline 0 CA--C 1.535 0.398 0 O-C-N 123.18 0.3 . . . . 0.0 110.388 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.17 163.0 30.59 Favored 'Trans proline' 0 C--N 1.369 1.631 0 C-N-CA 122.804 2.336 . . . . 0.0 112.725 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.527 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 55.4 Cg_endo -62.44 153.11 73.13 Favored 'Trans proline' 0 C--N 1.373 1.823 0 C-N-CA 123.009 2.473 . . . . 0.0 112.448 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.738 ' HE2' ' HD3' ' A' ' 37' ' ' ARG . 2.0 t80 -88.31 22.15 2.59 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.698 HG22 ' HG3' ' A' ' 13' ' ' LYS . 7.1 m -55.6 -5.86 0.16 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.94 0.496 . . . . 0.0 111.789 178.973 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.421 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . -28.7 -90.52 0.01 OUTLIER Glycine 0 C--N 1.352 1.472 0 C-N-CA 124.253 0.93 . . . . 0.0 114.446 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -89.58 14.37 2.18 Favored 'Trans proline' 0 C--N 1.362 1.273 0 C-N-CA 122.933 2.422 . . . . 0.0 113.38 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.1 m -137.97 122.49 18.46 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 120.603 0.24 . . . . 0.0 110.883 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' A' ' 9' ' ' THR . 0.3 OUTLIER -141.53 82.66 1.83 Allowed 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.865 179.725 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.86 -170.83 2.68 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.175 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.65 38.09 1.88 Allowed 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.041 0.448 . . . . 0.0 112.133 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.5 mt -129.96 102.02 6.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.482 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.923 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 44.9 mm -91.26 144.29 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.772 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.8 ' N ' ' O ' ' A' ' 31' ' ' PHE . 4.0 ttt180 -134.8 -154.78 0.61 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.657 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.497 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 10.6 m-85 -120.33 156.36 31.47 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.292 0.496 . . . . 0.0 111.73 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.581 ' HD1' ' O ' ' A' ' 29' ' ' GLN . 0.1 OUTLIER -164.75 179.91 6.27 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 114.838 -1.073 . . . . 0.0 112.131 177.716 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.434 ' CD1' ' HB2' ' A' ' 53' ' ' CYS . 63.6 t80 -94.76 168.74 10.63 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -142.95 123.54 14.05 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 120.056 1.298 . . . . 0.0 109.953 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.63 12.99 6.13 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.603 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -98.35 -39.04 9.0 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-O 121.035 0.445 . . . . 0.0 110.477 178.789 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.06 -35.65 5.6 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.388 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.06 -39.4 2.68 Favored Glycine 0 C--N 1.341 0.85 0 O-C-N 123.48 0.488 . . . . 0.0 112.615 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.755 HD23 ' H ' ' A' ' 27' ' ' LEU . 1.2 pt? -82.59 -163.83 0.76 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 98.3 m -111.0 144.91 39.36 Favored 'General case' 0 C--N 1.347 0.469 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.357 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.581 ' O ' ' HD1' ' A' ' 20' ' ' PHE . 3.2 tp-100 -144.44 169.24 18.31 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.611 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.8 p -87.09 126.94 35.09 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -178.115 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.8 ' O ' ' N ' ' A' ' 18' ' ' ARG . 1.8 p90 -122.64 170.93 9.53 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.247 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.923 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.5 p -76.14 -161.74 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 C-N-CA 123.449 0.699 . . . . 0.0 111.35 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.743 ' H ' HG22 ' A' ' 32' ' ' VAL . 71.2 t80 179.39 117.78 0.05 OUTLIER 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.681 1.192 . . . . 0.0 108.947 178.692 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -115.53 148.51 18.91 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.34 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -86.13 46.97 3.69 Favored Glycine 0 C--N 1.34 0.755 0 C-N-CA 121.499 -0.381 . . . . 0.0 112.33 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.7 p -95.19 -46.25 6.85 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.873 0.396 . . . . 0.0 111.34 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.738 ' HD3' ' HE2' ' A' ' 8' ' ' TYR . 53.9 ttt-85 -137.9 -36.97 0.6 Allowed 'General case' 0 CA--C 1.536 0.424 0 O-C-N 123.372 0.42 . . . . 0.0 111.216 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 63.47 116.03 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.59 0.756 . . . . 0.0 111.725 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.5 mmtt -105.46 -163.67 0.96 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.423 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.534 HH22 ' N ' ' A' ' 1' ' ' ASP . 89.1 mtm180 -82.38 -76.08 0.28 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.46 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -39.65 99.2 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -177.817 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -148.8 129.02 13.69 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 114.254 -1.339 . . . . 0.0 110.155 177.643 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.497 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 84.4 m-85 -134.19 148.02 50.84 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -98.47 -41.31 7.84 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.671 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.4 m -132.32 163.56 28.38 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.75 -55.51 29.41 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.194 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.463 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 60.4 mp0 -52.18 -28.63 18.96 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -80.38 -39.1 29.07 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.458 ' HA ' ' CE1' ' A' ' 43' ' ' PHE . 36.3 t -67.01 -24.06 65.98 Favored 'General case' 0 C--N 1.35 0.622 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.661 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.462 ' O ' ' N ' ' A' ' 54' ' ' GLY . 94.8 mtp -81.29 -55.99 4.36 Favored 'General case' 0 C--N 1.348 0.541 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.974 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 99.3 mtt180 -45.66 -37.4 5.69 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.823 0.449 . . . . 0.0 111.483 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.8 m -90.28 -58.53 2.47 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 123.483 0.489 . . . . 0.0 110.044 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -121.34 62.46 0.9 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.635 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.462 ' N ' ' O ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.336 0.537 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.574 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.556 0.217 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.45 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 3.0 p90 -118.66 -158.96 0.74 Allowed 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.115 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 56.0 m 73.03 -51.26 0.71 Allowed 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.346 1.058 . . . . 0.0 111.891 -179.362 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 23' ' ' ALA . 4.4 mm? -80.11 -2.2 43.47 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.727 0.411 . . . . 0.0 111.892 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -94.1 155.21 40.31 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.721 179.444 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -67.02 148.56 81.86 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.826 2.351 . . . . 0.0 112.945 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.511 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 38.3 Cg_endo -58.97 138.62 86.69 Favored 'Trans proline' 0 C--N 1.371 1.739 0 C-N-CA 123.624 2.882 . . . . 0.0 113.884 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.548 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 32.0 t80 -128.78 95.51 4.12 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.238 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.2 m -95.22 -70.8 0.7 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.563 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.2 160.23 23.39 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-O 119.288 -0.729 . . . . 0.0 112.141 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.99 64.21 6.03 Favored 'Trans proline' 0 C--N 1.369 1.644 0 C-N-CA 122.937 2.424 . . . . 0.0 112.753 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.6 m -132.0 -65.25 0.75 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.756 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.5 mptt 53.07 87.1 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.078 0.951 . . . . 0.0 112.342 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.519 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -87.28 48.92 1.72 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.255 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.2 OUTLIER 43.05 36.55 0.95 Allowed 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 178.87 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 38.1 mt -132.35 141.64 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.966 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.817 HG13 HG22 ' A' ' 32' ' ' VAL . 5.0 mp -117.85 103.33 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 122.159 0.981 . . . . 0.0 108.513 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.607 ' N ' ' O ' ' A' ' 31' ' ' PHE . 19.2 mtt180 -90.77 -169.04 2.24 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 113.106 -1.861 . . . . 0.0 111.404 -179.346 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.491 ' CE2' ' HB2' ' A' ' 46' ' ' ALA . 10.6 m-85 -124.84 158.96 32.16 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 122.334 0.254 . . . . 0.0 110.898 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.541 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 7.6 p90 -157.48 169.13 25.41 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 177.847 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.727 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 64.6 t80 -94.74 116.51 28.83 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.797 0.332 . . . . 0.0 110.955 179.089 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.595 HD21 ' HB2' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -98.69 83.68 3.01 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.542 179.443 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.52 ' HB2' HD13 ' A' ' 4' ' ' LEU . . . -55.68 -3.31 0.07 Allowed 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -179.082 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -96.48 -29.73 13.74 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' ALA . . . . . 0.46 ' HB3' ' HB2' ' A' ' 22' ' ' ASN . . . -89.96 -33.4 16.4 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.85 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.21 -15.9 15.4 Favored Glycine 0 C--N 1.344 0.984 0 C-N-CA 121.055 -0.593 . . . . 0.0 114.274 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 pp -154.26 -169.71 3.32 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 117.436 0.618 . . . . 0.0 111.737 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 58.8 m -81.7 139.82 34.68 Favored 'General case' 0 C--N 1.35 0.614 0 C-N-CA 122.867 0.467 . . . . 0.0 111.088 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.595 ' HB2' HD21 ' A' ' 22' ' ' ASN . 70.1 mt-30 -131.45 157.74 42.68 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.47 0.652 . . . . 0.0 112.653 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -77.81 130.14 36.32 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 113.382 -1.735 . . . . 0.0 111.766 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.607 ' O ' ' N ' ' A' ' 18' ' ' ARG . 5.9 p90 -150.93 151.59 32.37 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.299 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.817 HG22 HG13 ' A' ' 17' ' ' ILE . 20.7 t -76.59 125.19 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.833 0.853 . . . . 0.0 110.922 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.557 ' CG ' ' HD2' ' A' ' 18' ' ' ARG . 51.8 t80 -103.32 155.27 18.59 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.995 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.467 ' HA2' ' H ' ' A' ' 14' ' ' ALA . . . -105.8 -58.62 0.63 Allowed Glycine 0 C--N 1.336 0.566 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.496 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 87.33 17.95 58.05 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 121.473 -0.394 . . . . 0.0 113.004 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 25.5 p -95.05 -38.39 10.66 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 122.565 0.346 . . . . 0.0 111.245 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.409 ' HD3' ' OH ' ' A' ' 8' ' ' TYR . 59.9 ttt180 -126.92 29.68 5.6 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 123.411 0.444 . . . . 0.0 110.581 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -18.61 130.66 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.548 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 17.3 tptm -108.32 -132.57 0.32 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.424 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -123.35 -54.61 1.78 Allowed 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.45 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 59.9 t-20 -66.54 80.22 0.1 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.247 0.546 . . . . 0.0 111.372 -179.47 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -157.69 142.88 16.9 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.238 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -133.41 154.18 50.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.963 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -97.65 -46.94 5.81 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.04 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.7 t -112.95 150.48 31.79 Favored 'General case' 0 C--O 1.241 0.625 0 O-C-N 123.486 0.492 . . . . 0.0 111.509 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.491 ' HB2' ' CE2' ' A' ' 19' ' ' TYR . . . -68.04 -38.19 82.21 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.819 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 67.4 tt0 -57.25 -42.94 82.48 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 123.499 0.499 . . . . 0.0 110.998 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -70.6 -54.74 10.85 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.203 178.651 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 14.1 t -54.64 -29.69 53.05 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.463 0.477 . . . . 0.0 111.992 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.559 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 53.0 mtt -77.9 -47.96 17.48 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 122.819 0.448 . . . . 0.0 111.105 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 99.4 mtt180 -59.82 -30.88 69.23 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.398 0.436 . . . . 0.0 111.675 179.198 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.7 m -89.24 -55.81 3.52 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.727 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 2.7 p -138.98 68.58 1.38 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.015 0.436 . . . . 0.0 111.593 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.559 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.339 0.727 0 C-N-CA 121.086 -0.578 . . . . 0.0 112.466 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 120.519 0.199 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.844 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 6.5 p90 -95.78 5.87 50.28 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.977 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.6 t -86.16 -11.26 53.04 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.797 0.439 . . . . 0.0 111.289 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.756 ' HA ' ' HB2' ' A' ' 23' ' ' ALA . 50.9 mt -125.08 -4.01 7.5 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.821 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -93.77 146.92 32.63 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.464 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -78.76 162.81 26.75 Favored 'Trans proline' 0 C--N 1.371 1.739 0 C-N-CA 123.327 2.685 . . . . 0.0 112.915 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.622 ' HD3' ' HE2' ' A' ' 20' ' ' PHE . 66.8 Cg_endo -66.35 159.75 48.68 Favored 'Trans proline' 0 C--N 1.374 1.895 0 C-N-CA 123.202 2.601 . . . . 0.0 113.727 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.51 ' HB3' ' HG2' ' A' ' 39' ' ' LYS . 54.0 t80 -137.17 83.85 2.02 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.573 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.6 m -95.86 -55.88 2.85 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.232 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.89 -159.07 29.97 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 119.303 -0.721 . . . . 0.0 112.731 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -75.48 -1.1 10.9 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 123.017 2.478 . . . . 0.0 113.058 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.13 142.9 26.99 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.634 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -140.32 89.85 2.32 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.7 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.498 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -78.03 176.1 9.48 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.824 -179.171 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.503 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 0.1 OUTLIER -105.1 25.98 9.88 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.16 0.505 . . . . 0.0 111.823 -179.045 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 12.2 mt -127.66 86.76 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.571 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 1.011 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.6 mp -82.74 145.0 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.423 0.63 . . . . 0.0 109.798 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.483 HH21 ' HB3' ' A' ' 33' ' ' TYR . 5.8 ttm-85 -139.6 -161.46 1.19 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.22 -1.355 . . . . 0.0 110.395 -177.704 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.471 ' CE1' HG22 ' A' ' 30' ' ' THR . 3.9 m-85 -119.24 165.6 14.03 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 120.626 0.25 . . . . 0.0 111.52 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.622 ' HE2' ' HD3' ' A' ' 7' ' ' PRO . 1.6 p90 -166.08 -178.27 4.57 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.397 176.556 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.533 ' HE2' ' SD ' ' A' ' 50' ' ' MET . 34.7 t80 -125.27 130.12 51.41 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.492 ' ND2' ' CE2' ' A' ' 20' ' ' PHE . 23.6 m120 -106.52 125.46 51.03 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 120.621 0.248 . . . . 0.0 110.983 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.756 ' HB2' ' HA ' ' A' ' 4' ' ' LEU . . . -82.42 15.27 2.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.208 178.633 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.3 tptp -97.18 -39.92 9.05 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.503 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -102.62 -32.46 9.88 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.999 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 97.18 9.58 55.51 Favored Glycine 0 C--N 1.34 0.797 0 CA-C-N 115.904 -0.589 . . . . 0.0 114.088 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.508 ' HA ' ' CE ' ' A' ' 50' ' ' MET . 0.6 OUTLIER -132.93 173.89 10.92 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 117.292 0.546 . . . . 0.0 111.479 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.501 ' SG ' ' HD2' ' A' ' 21' ' ' TYR . 72.8 m -90.2 133.64 34.78 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.775 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -112.92 -162.36 0.8 Allowed 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.706 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.471 HG22 ' CE1' ' A' ' 19' ' ' TYR . 41.3 p -131.26 126.75 36.25 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.242 0.617 . . . . 0.0 109.741 178.932 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.541 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 2.5 p90 -145.19 149.18 34.49 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.586 -178.78 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 1.011 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -73.89 179.9 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 124.462 1.105 . . . . 0.0 112.251 -176.885 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.725 ' H ' HG12 ' A' ' 32' ' ' VAL . 50.8 t80 -158.54 135.24 9.57 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.784 0.834 . . . . 0.0 109.334 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.3 -174.27 14.18 Favored Glycine 0 C--N 1.336 0.529 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.838 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -89.56 8.51 79.68 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 121.535 -0.364 . . . . 0.0 113.029 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.452 ' HB2' ' HD2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -95.11 -52.07 4.37 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 122.724 0.409 . . . . 0.0 111.88 179.758 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.452 ' HD2' ' HB2' ' A' ' 36' ' ' CYS . 1.3 mpt_? -132.24 110.48 10.65 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.05 0.452 . . . . 0.0 111.321 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -101.08 140.92 34.71 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.801 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.51 ' HG2' ' HB3' ' A' ' 8' ' ' TYR . 6.9 mmtt -115.02 -162.18 0.81 Allowed 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.46 0.475 . . . . 0.0 110.777 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.2 mmt180 -125.16 3.54 7.89 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.863 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.844 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 60.4 t-20 -119.55 100.39 7.25 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.03 0.443 . . . . 0.0 110.162 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -134.68 132.2 38.62 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.824 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.486 ' CD1' ' HA ' ' A' ' 49' ' ' CYS . 55.0 m-85 -142.53 164.72 29.36 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.004 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -99.54 -44.84 6.01 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.166 0.186 . . . . 0.0 110.89 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -136.4 161.41 35.89 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.652 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.72 -25.72 67.61 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.647 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -59.72 -70.6 0.16 Allowed 'General case' 0 N--CA 1.474 0.742 0 O-C-N 123.413 0.445 . . . . 0.0 109.849 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -58.98 -40.16 84.0 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 122.88 0.472 . . . . 0.0 110.46 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.486 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 49.7 t -52.58 -58.16 7.69 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.758 0.661 . . . . 0.0 111.559 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.533 ' SD ' ' HE2' ' A' ' 21' ' ' TYR . 5.5 mmt -64.54 -42.24 95.85 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.7 tpp85 -70.25 -24.95 63.16 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.2 m -90.46 -40.63 11.91 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 122.995 0.185 . . . . 0.0 111.392 -179.627 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.9 -55.09 4.0 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.902 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.625 -179.954 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.497 0.189 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.602 ' H ' ' HD1' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -130.84 -20.08 2.86 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.848 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 18.7 m -71.21 -42.76 68.56 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 122.832 0.453 . . . . 0.0 112.14 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.3 mp -79.86 -7.89 58.98 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.172 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -92.74 153.32 42.24 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.939 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -64.08 139.66 68.09 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 122.705 2.27 . . . . 0.0 113.282 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.611 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 37.6 Cg_endo -58.43 136.46 74.46 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 123.555 2.836 . . . . 0.0 114.197 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -99.45 89.12 4.07 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.217 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.5 m -96.43 -63.37 1.15 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.458 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.574 ' HA3' ' HD2' ' A' ' 37' ' ' ARG . . . 84.76 -174.93 50.29 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 119.251 -0.749 . . . . 0.0 112.338 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.584 ' HD2' ' HE ' ' A' ' 37' ' ' ARG . 3.4 Cg_exo -76.95 17.88 0.8 Allowed 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.946 2.431 . . . . 0.0 113.141 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.74 132.48 56.15 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.651 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -139.02 86.21 2.12 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.243 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.494 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -80.32 52.99 1.69 Allowed 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.973 -1.012 . . . . 0.0 112.456 -179.083 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.494 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.4 OUTLIER 42.13 36.2 0.67 Allowed 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 178.903 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.599 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 37.6 mt -136.46 121.6 26.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-N 116.264 -0.426 . . . . 0.0 109.86 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.765 HG13 HG22 ' A' ' 32' ' ' VAL . 4.4 mp -121.91 106.36 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 122.177 0.989 . . . . 0.0 108.799 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.66 ' HG2' ' HG2' ' A' ' 44' ' ' LYS . 33.0 mtp180 -81.88 -160.07 0.33 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 113.227 -1.806 . . . . 0.0 111.178 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.561 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 15.7 m-85 -129.81 113.5 14.77 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.907 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.573 ' HA ' ' CB ' ' A' ' 42' ' ' ASN . 4.8 p90 -106.87 -174.59 2.57 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.644 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -128.42 134.72 48.85 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.326 0.107 . . . . 0.0 110.924 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -106.57 107.4 18.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.29 -2.73 6.43 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -96.38 -34.4 11.56 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.598 0.237 . . . . 0.0 110.588 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -92.18 -41.76 10.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.0 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.08 52.04 2.66 Favored Glycine 0 C--N 1.342 0.865 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 pp -166.35 162.14 16.96 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 123.108 0.563 . . . . 0.0 111.159 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 m -94.91 111.49 23.28 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.746 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.555 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 16.8 tp60 -87.73 -163.74 0.99 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.461 -179.065 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.672 ' HB ' HG22 ' A' ' 17' ' ' ILE . 33.6 p -129.4 133.37 47.33 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.162 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.64 ' O ' ' N ' ' A' ' 18' ' ' ARG . 14.3 p90 -133.97 148.24 51.13 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.893 0.378 . . . . 0.0 111.569 -178.192 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.765 HG22 HG13 ' A' ' 17' ' ' ILE . 10.9 t -77.06 125.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 123.933 0.893 . . . . 0.0 111.791 -178.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.642 ' HE1' ' H ' ' A' ' 39' ' ' LYS . 77.5 t80 -126.53 129.16 48.08 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.108 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.427 ' HA2' ' HB3' ' A' ' 14' ' ' ALA . . . -128.04 -170.82 12.89 Favored Glycine 0 C--N 1.336 0.547 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.274 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -87.98 -9.64 70.55 Favored Glycine 0 C--N 1.341 0.811 0 O-C-N 123.735 0.314 . . . . 0.0 112.947 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.72 -34.67 27.18 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.789 0.436 . . . . 0.0 112.143 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.584 ' HE ' ' HD2' ' A' ' 11' ' ' PRO . 84.0 mtt-85 -129.58 83.87 2.17 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.504 0.668 . . . . 0.0 110.383 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -93.09 117.63 30.29 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.511 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.642 ' H ' ' HE1' ' A' ' 33' ' ' TYR . 7.4 mmtt -147.06 -174.83 4.6 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.567 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -109.75 90.2 3.24 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.611 ' ND2' ' HA ' ' A' ' 7' ' ' PRO . 0.6 OUTLIER -87.27 -68.63 0.74 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.802 -178.265 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.573 ' CB ' ' HA ' ' A' ' 20' ' ' PHE . 9.1 t-20 -150.75 -94.55 0.06 Allowed 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.488 ' CD1' ' HB3' ' A' ' 48' ' ' ASP . 66.9 m-85 -154.77 168.88 25.39 Favored 'General case' 0 C--N 1.349 0.56 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.66 ' HG2' ' HG2' ' A' ' 18' ' ' ARG . 0.6 OUTLIER -95.66 -24.56 16.5 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.288 178.587 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.487 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 26.1 t -112.53 153.68 27.1 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 120.915 0.388 . . . . 0.0 111.665 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.4 -49.63 46.97 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.442 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.2 tt0 -56.32 -34.72 66.8 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.781 0.433 . . . . 0.0 111.151 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.488 ' HB3' ' CD1' ' A' ' 43' ' ' PHE . 51.7 m-20 -72.7 -51.03 20.99 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.495 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.6 t -60.79 -30.81 70.27 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.181 178.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 63.9 mtt -75.74 -49.38 18.4 Favored 'General case' 0 C--N 1.345 0.376 0 C-N-CA 123.022 0.529 . . . . 0.0 111.434 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 48' ' ' ASP . 17.4 ptm180 -61.35 -28.01 68.91 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.8 m -92.5 -61.99 1.49 Allowed 'General case' 0 CA--C 1.549 0.91 0 O-C-N 123.281 0.363 . . . . 0.0 111.681 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -92.32 -23.71 19.18 Favored 'General case' 0 C--N 1.346 0.429 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -178.426 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.7 0 C-N-CA 120.837 -0.697 . . . . 0.0 113.043 -179.489 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 120.531 0.205 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.68 -21.26 1.73 Allowed 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.491 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 0.7 OUTLIER -89.29 -13.84 37.14 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.871 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.744 HD23 ' HE2' ' A' ' 21' ' ' TYR . 75.2 mt -79.2 -8.5 59.06 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -95.56 153.92 39.37 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -66.34 167.0 19.64 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 123.058 2.506 . . . . 0.0 112.776 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.525 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 55.8 Cg_endo -60.87 126.0 18.56 Favored 'Trans proline' 0 C--N 1.375 1.974 0 C-N-CA 123.151 2.568 . . . . 0.0 112.542 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.536 ' CZ ' ' HD3' ' A' ' 37' ' ' ARG . 6.6 t80 -94.01 7.24 45.84 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.412 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.414 HG23 ' H ' ' A' ' 34' ' ' GLY . 7.3 m -55.79 -11.51 1.01 Allowed 'General case' 0 N--CA 1.484 1.244 0 O-C-N 122.272 -0.267 . . . . 0.0 111.615 179.15 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 53.14 -154.79 6.23 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.581 -0.736 . . . . 0.0 113.177 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -85.06 34.17 0.5 Allowed 'Trans proline' 0 C--N 1.367 1.505 0 C-N-CA 123.004 2.469 . . . . 0.0 112.292 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 34.5 m -87.56 -66.68 0.89 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.785 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 64.9 96.4 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.847 0.859 . . . . 0.0 111.701 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.473 ' HB2' ' HA2' ' A' ' 34' ' ' GLY . . . -91.51 -141.1 0.18 Allowed 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.185 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.523 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 2.4 ppt_? -135.21 24.28 3.52 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.163 0.506 . . . . 0.0 111.748 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.492 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 33.0 mt -132.56 102.47 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.29 -179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.944 HG13 HG22 ' A' ' 32' ' ' VAL . 3.2 mp -91.12 150.39 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 121.368 0.604 . . . . 0.0 109.596 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.82 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 17.1 mtt180 -145.21 -158.89 0.93 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.666 -178.492 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.608 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 5.7 m-85 -124.8 115.27 20.42 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.608 ' HB3' ' CD1' ' A' ' 31' ' ' PHE . 9.3 p90 -106.83 -167.65 1.31 Allowed 'General case' 0 CA--C 1.553 1.063 0 O-C-N 123.911 0.757 . . . . 0.0 109.565 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.744 ' HE2' HD23 ' A' ' 4' ' ' LEU . 0.8 OUTLIER -140.44 128.25 21.84 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.979 -0.451 . . . . 0.0 110.964 179.395 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -93.9 116.87 29.35 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 177.596 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.41 13.49 2.42 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.952 0.406 . . . . 0.0 111.31 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -97.04 -33.2 11.63 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.873 178.251 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.39 -47.49 3.38 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.157 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.08 -39.95 1.86 Allowed Glycine 0 C--N 1.345 1.043 0 C-N-CA 121.368 -0.444 . . . . 0.0 112.467 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.88 158.56 36.2 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -178.082 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.527 ' SG ' ' O ' ' A' ' 20' ' ' PHE . 35.9 t -97.49 118.86 34.93 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.047 178.769 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -104.78 -162.4 0.88 Allowed 'General case' 0 N--CA 1.466 0.329 0 O-C-N 122.989 0.181 . . . . 0.0 111.267 -177.565 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.603 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 37.3 p -114.38 154.81 27.42 Favored 'General case' 0 C--N 1.344 0.35 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.608 ' CD1' ' HB3' ' A' ' 20' ' ' PHE . 4.7 p90 -160.75 151.39 18.34 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.788 0.328 . . . . 0.0 110.796 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.944 HG22 HG13 ' A' ' 17' ' ' ILE . 5.8 t -87.07 136.49 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.31 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.43 ' OH ' ' HB1' ' A' ' 38' ' ' ALA . 44.0 t80 -102.18 111.27 23.48 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.701 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.473 ' HA2' ' HB2' ' A' ' 14' ' ' ALA . . . -100.06 151.55 19.18 Favored Glycine 0 C--N 1.336 0.551 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.661 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -92.29 34.17 4.57 Favored Glycine 0 C--N 1.338 0.663 0 C-N-CA 121.511 -0.375 . . . . 0.0 112.739 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.5 p -95.26 -39.9 9.83 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 122.47 0.308 . . . . 0.0 111.15 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.536 ' HD3' ' CZ ' ' A' ' 8' ' ' TYR . 88.2 mtt-85 -129.51 -50.16 1.17 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.467 0.48 . . . . 0.0 110.81 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . 0.43 ' HB1' ' OH ' ' A' ' 33' ' ' TYR . . . 60.18 136.38 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.111 0.964 . . . . 0.0 113.137 179.27 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -138.23 -170.77 2.88 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.397 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -104.55 52.07 0.76 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.464 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.491 ' ND2' ' HA ' ' A' ' 3' ' ' CYS . 61.1 t-20 -145.44 91.21 2.09 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.053 0.454 . . . . 0.0 110.727 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.82 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 2.8 m-80 -153.68 131.5 11.62 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.117 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.608 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 35.5 m-85 -134.61 132.2 38.74 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.834 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.758 ' HD3' ' HE ' ' A' ' 18' ' ' ARG . 3.6 mmmp? -95.48 -5.1 43.7 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.889 -179.493 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -137.79 143.25 40.99 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.104 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.24 -53.31 38.49 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.658 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -55.14 -39.16 69.13 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.265 0.626 . . . . 0.0 111.917 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -74.34 -36.65 63.66 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 35.1 t -64.29 -27.74 69.24 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 115.074 -0.967 . . . . 0.0 110.017 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 94.1 mtp -80.55 -48.56 12.55 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.754 178.06 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.34 -38.65 43.15 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.128 0.571 . . . . 0.0 111.243 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.0 m -99.15 -54.72 2.89 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 123.308 0.38 . . . . 0.0 110.947 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -103.37 39.92 1.5 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -178.64 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.308 0 CA-C-N 116.202 -0.453 . . . . 0.0 112.5 179.194 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 1' ' ' ASP . . . . . 0.742 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 54.0 m-20 . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 120.488 0.185 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.548 ' O ' ' HB2' ' A' ' 41' ' ' ASN . 24.8 p90 -123.39 -34.37 3.11 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.7 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.37 -9.25 39.4 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.407 0.442 . . . . 0.0 111.017 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.742 ' HB2' ' HB3' ' A' ' 1' ' ' ASP . 2.8 mm? -83.13 -7.43 59.63 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.298 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -94.15 157.27 37.96 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 122.485 0.314 . . . . 0.0 111.244 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -62.9 171.51 5.92 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 122.943 2.429 . . . . 0.0 112.671 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.56 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 23.2 Cg_endo -53.01 133.88 53.63 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 123.515 2.81 . . . . 0.0 113.298 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.622 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 60.4 t80 -122.55 54.06 1.22 Allowed 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.261 -178.242 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.547 HG22 ' O ' ' A' ' 12' ' ' CYS . 20.4 m -96.08 12.59 30.08 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 36.71 -143.75 0.14 Allowed Glycine 0 CA--C 1.537 1.407 0 CA-C-N 114.287 -1.324 . . . . 0.0 114.398 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -81.13 1.8 9.04 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 123.111 2.541 . . . . 0.0 113.131 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.547 ' O ' HG22 ' A' ' 9' ' ' THR . 0.1 OUTLIER -98.12 149.11 22.86 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.879 -179.769 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -146.89 96.21 2.71 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.856 0.862 . . . . 0.0 109.381 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.558 ' CB ' ' HA2' ' A' ' 34' ' ' GLY . . . -79.4 33.92 0.25 Allowed 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.897 -1.047 . . . . 0.0 113.163 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.606 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER 44.9 26.83 0.23 Allowed 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 178.408 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 14' ' ' ALA . 28.4 mt -130.22 118.43 43.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.31 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 1.058 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 34.4 mt -81.07 139.24 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-O 121.624 0.726 . . . . 0.0 110.288 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.85 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 3.8 ttt180 -131.93 -170.49 2.41 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.927 -177.919 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.3 m-85 -126.3 154.06 43.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 122.487 0.315 . . . . 0.0 111.028 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.643 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 10.3 p90 -144.75 158.6 43.72 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.376 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.428 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 12.3 t80 -90.87 120.34 31.81 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.621 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -103.48 100.22 10.07 Favored 'General case' 0 C--O 1.244 0.811 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 175.862 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.03 16.25 0.25 Allowed 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -178.974 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -96.2 -26.16 15.55 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.873 178.899 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -116.79 -38.08 3.51 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.317 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 104.82 31.35 4.52 Favored Glycine 0 C--N 1.343 0.919 0 C-N-CA 121.276 -0.488 . . . . 0.0 113.304 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.658 ' HA ' ' SD ' ' A' ' 50' ' ' MET . 0.5 OUTLIER -152.42 168.44 25.48 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.896 0.379 . . . . 0.0 111.499 179.509 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.559 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 97.7 m -94.54 127.5 40.52 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.772 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.566 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 52.5 tp60 -94.74 159.13 15.2 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.074 -179.02 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 37.0 p -94.98 124.53 39.08 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.666 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.713 ' O ' ' N ' ' A' ' 18' ' ' ARG . 3.7 p90 -155.58 160.93 40.87 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.287 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 1.058 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.5 t -72.8 -179.02 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.061 0 C-N-CA 123.294 0.638 . . . . 0.0 111.87 -177.081 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.752 ' H ' HG12 ' A' ' 32' ' ' VAL . 48.7 t80 -148.71 155.76 41.45 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.037 -178.544 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.558 ' HA2' ' CB ' ' A' ' 14' ' ' ALA . . . -142.95 140.52 9.82 Favored Glycine 0 C--N 1.335 0.526 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.767 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -78.64 2.21 68.94 Favored Glycine 0 C--N 1.341 0.823 0 C-N-CA 121.523 -0.37 . . . . 0.0 113.036 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.56 -2.92 47.45 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -133.55 -13.33 2.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -8.81 119.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.951 1.3 . . . . 0.0 114.389 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.622 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 21.7 tptm -127.65 -108.88 0.29 Allowed 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.828 -178.457 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -153.27 -32.35 0.12 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.726 0.81 . . . . 0.0 111.684 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.573 HD21 ' HB2' ' A' ' 20' ' ' PHE . 14.2 t30 -67.8 -2.56 7.38 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.033 0.933 . . . . 0.0 113.396 -178.979 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.85 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 15.8 m-20 -105.34 139.37 40.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.868 0.366 . . . . 0.0 110.716 -178.793 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.445 ' C ' ' HG2' ' A' ' 18' ' ' ARG . 5.5 m-85 -151.96 126.26 9.32 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.154 -178.049 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.76 ' HD2' ' HE ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -65.06 -39.78 93.75 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -179.774 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -99.67 128.73 45.77 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 120.987 0.422 . . . . 0.0 111.997 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.15 -41.23 99.24 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.993 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 51' ' ' ARG . 20.1 pt-20 -48.14 -55.91 9.14 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.917 0.76 . . . . 0.0 111.6 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -66.67 -45.94 77.29 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 122.457 0.303 . . . . 0.0 110.677 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.7 t -47.3 -51.91 17.8 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.809 0.693 . . . . 0.0 110.873 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.797 ' HA ' ' HE2' ' A' ' 50' ' ' MET . 8.5 mmt -74.79 -33.26 62.21 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.955 0.502 . . . . 0.0 111.573 178.677 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 67.0 ttt180 -60.13 -29.27 68.52 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.163 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.4 m -101.55 -52.94 3.1 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.493 0.496 . . . . 0.0 110.824 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.428 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -102.7 28.8 5.78 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -178.467 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.459 0.168 0 O-C-N 121.789 -0.569 . . . . 0.0 112.506 179.324 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.3 t70 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.517 0.199 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.674 ' HB2' ' O ' ' A' ' 40' ' ' ARG . 4.3 p90 -128.28 -6.9 5.34 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.784 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.613 ' HB3' ' HB3' ' A' ' 21' ' ' TYR . 57.0 m -72.88 -50.99 20.43 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -84.16 43.53 0.95 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.427 0.632 . . . . 0.0 112.014 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -127.17 153.77 76.79 Favored Pre-proline 0 CA--C 1.537 0.476 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.446 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.95 134.77 41.32 Favored 'Trans proline' 0 C--N 1.371 1.725 0 C-N-CA 122.549 2.166 . . . . 0.0 113.396 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -57.87 141.02 95.71 Favored 'Trans proline' 0 C--N 1.372 1.776 0 C-N-CA 123.659 2.906 . . . . 0.0 113.86 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -117.06 102.38 9.28 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.463 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.0 m -95.93 -83.0 0.38 Allowed 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.73 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.14 137.64 8.29 Favored Glycine 0 C--N 1.341 0.824 0 CA-C-O 118.933 -0.926 . . . . 0.0 110.946 -178.399 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.05 83.16 0.26 Allowed 'Trans proline' 0 C--N 1.37 1.685 0 C-N-CA 122.802 2.334 . . . . 0.0 112.847 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.6 m -138.2 -167.6 2.2 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.33 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -99.7 72.5 1.75 Allowed 'General case' 0 C--O 1.238 0.476 0 CA-C-O 122.195 0.998 . . . . 0.0 108.834 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.55 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -77.45 -55.63 5.22 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 113.901 -1.5 . . . . 0.0 113.104 -177.886 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.55 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.3 OUTLIER 46.95 22.39 0.2 Allowed 'General case' 0 N--CA 1.497 1.884 0 C-N-CA 124.523 1.129 . . . . 0.0 113.792 -179.57 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.563 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 27.4 mt -135.76 142.02 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.431 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.85 HG13 HG22 ' A' ' 32' ' ' VAL . 4.5 mp -121.23 108.61 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 122.131 0.967 . . . . 0.0 108.952 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 1.024 ' HG2' ' HA ' ' A' ' 44' ' ' LYS . 27.2 mtt180 -86.5 -167.02 1.72 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 113.116 -1.857 . . . . 0.0 111.507 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.547 ' CE2' ' HB2' ' A' ' 46' ' ' ALA . 42.4 m-85 -128.91 151.16 49.95 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.633 ' HA ' ' CB ' ' A' ' 42' ' ' ASN . 3.8 p90 -147.52 155.52 41.95 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.294 0.371 . . . . 0.0 110.669 178.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.626 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 14.9 t80 -83.7 116.89 22.88 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -178.62 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.538 ' C ' ' H ' ' A' ' 24' ' ' LYS . 3.2 m120 -110.56 91.11 3.53 Favored 'General case' 0 C--O 1.246 0.902 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.253 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.02 15.86 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 120.944 0.402 . . . . 0.0 111.693 -179.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' LYS . . . . . 0.538 ' H ' ' C ' ' A' ' 22' ' ' ASN . 46.5 tptt -97.78 -37.97 9.65 Favored 'General case' 0 C--N 1.345 0.372 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.455 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.18 -15.27 18.99 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.073 179.092 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.02 13.28 72.11 Favored Glycine 0 C--N 1.349 1.265 0 N-CA-C 114.663 0.625 . . . . 0.0 114.663 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -154.3 -176.01 5.67 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 117.307 0.554 . . . . 0.0 111.378 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 31.5 m -84.6 156.38 21.61 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.989 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.626 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 56.1 tp60 -134.78 153.78 51.88 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-O 120.961 0.41 . . . . 0.0 110.395 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.419 ' HB ' ' CG2' ' A' ' 17' ' ' ILE . 35.2 p -78.26 122.97 26.41 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.43 -179.27 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.72 ' O ' ' N ' ' A' ' 18' ' ' ARG . 3.0 p90 -141.91 142.07 33.02 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.49 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.85 HG22 HG13 ' A' ' 17' ' ' ILE . 48.3 t -78.01 126.76 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 123.984 0.914 . . . . 0.0 111.462 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.491 ' O ' ' HB1' ' A' ' 14' ' ' ALA . 42.1 t80 -112.23 131.8 55.29 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.168 179.629 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.474 ' HA2' ' HB2' ' A' ' 14' ' ' ALA . . . -89.64 153.59 23.36 Favored Glycine 0 C--N 1.34 0.801 0 O-C-N 123.701 0.625 . . . . 0.0 113.238 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.31 8.89 69.62 Favored Glycine 0 C--N 1.338 0.656 0 O-C-N 123.82 0.364 . . . . 0.0 113.162 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.2 p -94.94 -43.83 7.99 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 122.503 0.321 . . . . 0.0 110.876 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.3 mtt-85 -119.27 124.47 46.78 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.942 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -111.59 138.07 48.62 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.899 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.636 ' HZ2' ' HB3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -142.98 -170.72 3.31 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.859 179.575 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' ARG . . . . . 0.674 ' O ' ' HB2' ' A' ' 2' ' ' PHE . 80.4 mmt-85 -121.62 91.31 3.49 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.56 ' O ' ' HD1' ' A' ' 2' ' ' PHE . 46.3 t30 -107.57 -52.59 2.74 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.972 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.633 ' CB ' ' HA ' ' A' ' 20' ' ' PHE . 1.1 m120 -160.82 -103.01 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.447 0.467 . . . . 0.0 110.431 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.403 ' HB2' ' HB2' ' A' ' 49' ' ' CYS . 55.0 m-85 -150.96 -173.8 4.6 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -177.151 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 1.024 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 12.5 tppt? -97.79 -42.24 7.68 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.688 177.741 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.5 m -108.86 155.32 20.95 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.906 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.547 ' HB2' ' CE2' ' A' ' 19' ' ' TYR . . . -68.41 -37.35 80.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.92 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -54.35 -50.94 66.27 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.701 0.4 . . . . 0.0 111.643 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -70.52 -52.33 22.56 Favored 'General case' 0 C--N 1.345 0.39 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.969 178.407 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.432 ' SG ' ' ND2' ' A' ' 42' ' ' ASN . 41.9 t -49.5 -34.59 17.48 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.187 0.595 . . . . 0.0 112.309 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.613 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 59.0 mtt -78.77 -47.16 17.32 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 122.941 0.496 . . . . 0.0 111.607 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -58.05 -33.32 68.9 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 123.799 0.687 . . . . 0.0 111.58 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.9 m -86.22 -55.16 4.05 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.626 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 2.2 p -149.61 74.25 1.22 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.059 0.457 . . . . 0.0 112.118 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.613 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.339 0.715 0 C-N-CA 121.199 -0.525 . . . . 0.0 112.728 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 120.505 0.193 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.469 ' HE1' ' CZ ' ' A' ' 43' ' ' PHE . 1.3 p90 -125.93 -26.06 3.51 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.044 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.555 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 24.9 t -86.67 -14.15 43.42 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.222 0.326 . . . . 0.0 111.807 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.425 HD22 ' CD2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -79.67 -8.69 59.37 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 179.966 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -95.6 157.54 35.94 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -70.58 167.73 24.66 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.85 2.366 . . . . 0.0 112.523 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.498 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 37.9 Cg_endo -58.25 132.92 51.85 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 123.257 2.638 . . . . 0.0 112.968 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -92.72 -0.53 57.26 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.7 m -40.87 -22.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.901 0.88 . . . . 0.0 113.218 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 55.65 -150.92 20.75 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-O 119.409 -0.662 . . . . 0.0 113.511 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -81.9 13.17 2.56 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 123.159 2.573 . . . . 0.0 112.484 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.5 m -84.89 154.58 22.15 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.889 -179.591 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -133.32 73.42 1.51 Allowed 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.341 0.591 . . . . 0.0 111.19 -179.345 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.697 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . . . -86.92 172.26 10.18 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.411 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.856 ' HE ' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -110.79 45.14 1.18 Allowed 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.015 0.436 . . . . 0.0 111.521 -179.414 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.3 mt -131.81 92.08 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 1.141 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.1 mp -76.24 144.25 12.07 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-O 121.565 0.697 . . . . 0.0 110.131 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.95 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 68.1 mtt180 -150.56 -178.23 6.43 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.41 -177.677 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.83 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 1.5 m-85 -123.31 152.98 40.88 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.498 ' CE2' ' HD3' ' A' ' 7' ' ' PRO . 8.1 p90 -144.76 168.7 19.58 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 124.054 0.846 . . . . 0.0 109.582 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.684 ' CD2' ' HB2' ' A' ' 53' ' ' CYS . 3.8 t80 -106.86 128.87 54.66 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.418 ' ND2' ' HB2' ' A' ' 29' ' ' GLN . 69.1 m-80 -105.97 109.95 22.07 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 175.43 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.79 21.3 0.68 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.249 0.547 . . . . 0.0 110.805 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 tppt? -96.19 -23.74 16.58 Favored 'General case' 0 C--N 1.345 0.405 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.522 178.908 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -127.52 -31.15 2.52 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.198 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.415 ' HA2' ' HE1' ' A' ' 21' ' ' TYR . . . 95.44 31.29 7.6 Favored Glycine 0 C--N 1.344 0.978 0 O-C-N 123.391 0.432 . . . . 0.0 112.292 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 pp -135.72 163.53 29.96 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-O 121.007 0.432 . . . . 0.0 111.896 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.83 ' SG ' ' HB3' ' A' ' 19' ' ' TYR . 48.9 t -98.5 119.01 36.47 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.625 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.444 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 0.3 OUTLIER -96.16 153.01 18.03 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.563 -178.074 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.463 HG22 ' CZ ' ' A' ' 19' ' ' TYR . 46.2 p -90.38 123.11 33.85 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.019 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.447 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 2.6 p90 -143.08 138.05 29.63 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.701 -179.364 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 1.141 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.0 t -80.21 88.43 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.524 1.13 . . . . 0.0 113.009 -178.257 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.486 ' HB3' ' HD2' ' A' ' 18' ' ' ARG . 25.0 t80 -52.27 125.38 15.74 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.962 0.505 . . . . 0.0 110.995 178.445 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.697 ' HA2' ' HB3' ' A' ' 14' ' ' ALA . . . -83.26 150.46 27.34 Favored Glycine 0 C--N 1.34 0.789 0 CA-C-N 115.871 -0.604 . . . . 0.0 113.495 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.41 23.61 23.97 Favored Glycine 0 C--N 1.339 0.716 0 O-C-N 123.785 0.344 . . . . 0.0 112.898 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.9 p -95.06 -46.93 6.6 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.526 0.33 . . . . 0.0 110.451 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -126.57 126.58 43.89 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.65 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -100.93 131.42 46.81 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -145.54 165.14 29.5 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.052 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 46.9 mmm-85 -78.3 1.63 21.14 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.823 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -89.8 72.61 7.6 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 120.924 0.393 . . . . 0.0 110.431 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.95 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 74.4 m-80 -156.7 133.69 10.37 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.718 179.172 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.523 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 31.9 m-85 -137.78 101.77 4.55 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.991 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.731 ' HE2' ' HE ' ' A' ' 18' ' ' ARG . 51.6 mmtt -67.13 -22.85 65.77 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.9 m -113.76 133.31 55.45 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.763 0.316 . . . . 0.0 111.834 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.93 -47.59 77.15 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.915 179.108 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -48.14 -56.77 7.04 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 123.918 0.761 . . . . 0.0 110.661 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ASP . . . . . 0.705 ' HA ' ' HG2' ' A' ' 51' ' ' ARG . 57.1 m-20 -58.99 -49.66 77.04 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 122.608 0.363 . . . . 0.0 110.588 178.765 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.5 t -46.4 -49.74 17.59 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 123.934 0.771 . . . . 0.0 111.135 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 96.0 mtp -68.9 -43.55 75.02 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.705 ' HG2' ' HA ' ' A' ' 48' ' ' ASP . 33.3 ptt180 -70.21 -16.19 63.02 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.8 m -102.94 -49.56 3.75 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 123.209 0.318 . . . . 0.0 110.604 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.684 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 1.3 p -123.48 34.81 5.0 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.459 0.197 0 C-N-CA 121.083 -0.58 . . . . 0.0 112.458 179.884 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 1' ' ' ASP . . . . . 0.529 ' OD2' HD21 ' A' ' 4' ' ' LEU . 47.8 t0 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.553 0.216 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -128.5 -173.21 2.9 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.104 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.403 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 26.4 t 70.64 -47.9 0.65 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.705 1.202 . . . . 0.0 112.796 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.547 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 3.7 pp -81.85 -6.38 59.03 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' GLU . . . . . 0.442 ' HB3' ' HD2' ' A' ' 6' ' ' PRO . 55.2 mm-40 -87.32 163.85 37.89 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.562 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.442 ' HD2' ' HB3' ' A' ' 5' ' ' GLU . 13.7 Cg_endo -56.36 130.12 38.42 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.555 2.17 . . . . 0.0 113.223 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.566 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 21.4 Cg_endo -52.71 136.04 57.7 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 124.121 3.214 . . . . 0.0 114.408 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -130.1 117.49 20.05 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.612 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.422 HG23 ' HA ' ' A' ' 33' ' ' TYR . 41.2 m -96.28 -71.94 0.65 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.378 179.389 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.466 ' HA3' ' CB ' ' A' ' 37' ' ' ARG . . . 112.03 147.66 10.58 Favored Glycine 0 C--N 1.34 0.775 0 CA-C-O 119.146 -0.808 . . . . 0.0 111.511 -178.772 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.408 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 2.7 Cg_exo -76.4 49.12 2.54 Favored 'Trans proline' 0 C--N 1.368 1.553 0 C-N-CA 122.882 2.388 . . . . 0.0 113.055 -179.363 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' CYS . . . . . 0.69 ' HB2' ' HG2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -146.53 133.04 19.73 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.309 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.788 ' HE2' ' H ' ' A' ' 13' ' ' LYS . 0.4 OUTLIER 28.99 47.28 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 125.196 1.398 . . . . 0.0 114.549 178.796 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.652 ' HA ' ' HA2' ' A' ' 34' ' ' GLY . . . -89.52 100.25 13.09 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.913 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -155.54 30.56 0.38 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.386 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 33' ' ' TYR . 46.8 mt -143.07 128.92 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.692 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.798 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.2 mp -93.66 142.8 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.731 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.67 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 37.8 mtt180 -137.19 -176.24 4.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.678 -177.723 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.533 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.1 m-85 -116.64 148.03 41.36 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.686 0.279 . . . . 0.0 111.584 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.585 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 2.9 p90 -139.54 155.63 47.39 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.59 ' CZ ' ' HA2' ' A' ' 26' ' ' GLY . 68.4 t80 -90.38 131.97 35.86 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -99.87 130.46 46.06 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 176.962 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.39 9.93 27.06 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 123.349 0.406 . . . . 0.0 111.781 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -97.61 -24.74 15.39 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.048 179.301 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -134.97 -28.93 1.15 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.672 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.59 ' HA2' ' CZ ' ' A' ' 21' ' ' TYR . . . 95.95 8.62 57.89 Favored Glycine 0 C--N 1.342 0.914 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.297 -178.763 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 pp -95.7 151.61 19.21 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 123.834 0.373 . . . . 0.0 111.901 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 96.4 m -96.13 109.97 22.32 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.124 178.73 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.585 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 53.4 tp60 -92.15 156.94 17.0 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.031 -177.542 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.468 HG22 ' CE1' ' A' ' 19' ' ' TYR . 34.0 p -89.78 128.37 36.13 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.294 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.578 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 6.9 p90 -150.66 150.52 31.23 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.796 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.798 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.2 t -76.74 161.35 4.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 123.656 0.783 . . . . 0.0 112.395 -177.972 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.489 ' N ' ' O ' ' A' ' 16' ' ' ILE . 32.7 t80 -136.85 158.17 45.08 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.904 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.652 ' HA2' ' HA ' ' A' ' 14' ' ' ALA . . . -105.76 -164.33 23.31 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 121.146 -0.549 . . . . 0.0 113.324 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLY . . . . . 0.518 ' HA3' ' HB2' ' A' ' 13' ' ' LYS . . . -109.47 -60.83 0.52 Allowed Glycine 0 C--N 1.339 0.699 0 O-C-N 123.788 0.346 . . . . 0.0 112.716 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' CYS . . . . . 0.569 ' SG ' ' HD2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -80.05 -19.56 47.31 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 179.757 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.69 ' HG2' ' HB2' ' A' ' 12' ' ' CYS . 71.9 mmt-85 -96.85 102.95 14.82 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.053 0.454 . . . . 0.0 110.851 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -120.42 148.49 43.72 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.569 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.9 tmtp? -137.13 -124.78 0.14 Allowed 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.482 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -143.99 -1.24 0.98 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.781 0.433 . . . . 0.0 111.622 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.4 ' OD1' ' HA ' ' A' ' 3' ' ' CYS . 61.4 t-20 -109.15 78.48 1.14 Allowed 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.807 0.337 . . . . 0.0 111.737 -179.058 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.67 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 8.7 m-80 -155.63 123.89 5.85 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.81 177.472 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 36.5 m-85 -134.65 103.32 5.61 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.138 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.434 ' HG2' ' HG2' ' A' ' 18' ' ' ARG . 6.5 tmtt? -74.31 0.62 13.73 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.002 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.2 m -134.92 134.22 40.4 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.269 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.93 -45.99 86.75 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.295 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -49.11 -55.96 10.6 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.781 0.676 . . . . 0.0 110.786 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -62.53 -47.45 83.84 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 122.398 0.279 . . . . 0.0 110.763 178.768 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.506 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 53.7 t -46.68 -48.96 20.0 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 123.824 0.702 . . . . 0.0 111.37 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.5 mtt -73.69 -39.26 64.51 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 86.8 mtm180 -69.13 -19.76 64.03 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.5 m -105.72 -51.49 2.99 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 122.983 0.177 . . . . 0.0 110.841 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.506 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.2 OUTLIER -109.42 21.04 17.55 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -178.681 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.755 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.545 178.589 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 N--CA 1.488 1.468 0 CA-C-O 120.519 0.2 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -127.82 -164.87 1.41 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.238 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 3' ' ' CYS . . . . . 0.722 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 13.9 t 72.51 -39.66 0.45 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.808 1.243 . . . . 0.0 112.35 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.435 HD23 ' CD1' ' A' ' 21' ' ' TYR . 23.1 mt -79.51 -4.95 53.67 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -95.14 151.37 38.74 Favored Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.198 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' PRO . . . . . 0.408 ' HA ' ' HE2' ' A' ' 20' ' ' PHE . 39.2 Cg_endo -67.18 169.34 15.43 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.927 2.418 . . . . 0.0 112.908 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' PRO . . . . . 0.585 ' HD3' ' CZ ' ' A' ' 20' ' ' PHE . 36.5 Cg_endo -57.81 130.01 36.35 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 123.037 2.491 . . . . 0.0 113.101 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.959 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 9.9 t80 -95.22 -19.76 19.77 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.592 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.6 m -8.94 -80.67 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.613 0.765 . . . . 0.0 109.609 -176.876 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.39 -159.47 19.01 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.611 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -78.72 13.07 2.0 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 123.073 2.515 . . . . 0.0 113.143 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.6 m -94.85 -59.53 1.89 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.928 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt 57.51 91.23 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.095 0.958 . . . . 0.0 112.33 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . 0.504 ' CB ' ' HA2' ' A' ' 34' ' ' GLY . . . -80.98 -158.33 0.2 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.402 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.68 37.71 4.25 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.071 0.462 . . . . 0.0 111.814 -179.513 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.0 mt -129.96 91.74 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.712 -179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.894 HG13 HG22 ' A' ' 32' ' ' VAL . 2.9 mp -76.39 153.87 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.079 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.599 ' N ' ' O ' ' A' ' 31' ' ' PHE . 39.2 mtt180 -154.8 -179.59 8.17 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.625 -177.952 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.749 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 2.2 m-85 -112.39 156.91 21.72 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-N 118.32 0.509 . . . . 0.0 111.731 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.585 ' CZ ' ' HD3' ' A' ' 7' ' ' PRO . 1.8 p90 -158.56 167.05 30.63 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 124.597 1.186 . . . . 0.0 108.981 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.722 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 5.5 t80 -81.71 133.8 35.39 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 118.419 0.554 . . . . 0.0 112.166 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 22' ' ' ASN . . . . . 0.487 ' ND2' ' CE2' ' A' ' 20' ' ' PHE . 28.5 m120 -141.27 112.88 7.61 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.104 178.471 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.92 7.28 4.99 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.0 177.969 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -96.87 -41.04 8.63 Favored 'General case' 0 C--N 1.348 0.537 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.017 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.44 -48.05 9.37 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.981 179.632 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 169.49 -62.54 0.18 Allowed Glycine 0 C--N 1.336 0.576 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.659 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.726 HD12 ' N ' ' A' ' 28' ' ' CYS . 2.3 pp -150.62 -52.49 0.14 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.368 0.267 . . . . 0.0 110.822 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' CYS . . . . . 0.726 ' N ' HD12 ' A' ' 27' ' ' LEU . 58.5 m -133.86 144.64 49.05 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.538 0.335 . . . . 0.0 110.24 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.508 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 63.3 tp60 -145.81 159.23 43.5 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.405 0.622 . . . . 0.0 112.273 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 34.9 p -77.54 142.28 39.12 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 113.946 -1.479 . . . . 0.0 112.244 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.599 ' O ' ' N ' ' A' ' 18' ' ' ARG . 6.7 p90 -152.64 147.35 26.04 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.388 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.894 HG22 HG13 ' A' ' 17' ' ' ILE . 3.2 t -99.13 110.37 26.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.241 0.617 . . . . 0.0 111.363 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.426 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 48.8 t80 -78.49 136.07 37.5 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.702 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' GLY . . . . . 0.504 ' HA2' ' CB ' ' A' ' 14' ' ' ALA . . . -92.59 155.59 22.75 Favored Glycine 0 C--N 1.338 0.664 0 O-C-N 123.561 0.538 . . . . 0.0 112.906 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -98.66 11.95 62.87 Favored Glycine 0 C--N 1.337 0.625 0 C-N-CA 121.433 -0.413 . . . . 0.0 113.346 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 17.5 p -95.14 -44.61 7.56 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.771 0.285 . . . . 0.0 110.73 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -124.76 153.49 42.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.025 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -100.6 151.02 22.1 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.276 0.56 . . . . 0.0 112.161 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.959 ' HD3' ' HB3' ' A' ' 8' ' ' TYR . 13.0 ttpp -134.07 165.18 25.66 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.356 -179.194 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 86.4 mtm180 -112.47 18.7 18.23 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.648 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.919 ' H ' ' HG2' ' A' ' 39' ' ' LYS . 64.7 t-20 -126.96 97.45 4.97 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.172 0.51 . . . . 0.0 110.936 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -146.23 147.93 31.95 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.543 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.749 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 56.1 m-85 -160.53 81.19 0.67 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.759 0.662 . . . . 0.0 109.853 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' LYS . . . . . 0.519 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 20.2 tptm -43.25 -28.04 0.28 Allowed 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -178.158 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.4 m -136.65 154.91 50.51 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.666 0.269 . . . . 0.0 111.636 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -59.62 -50.62 73.17 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.51 179.028 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.489 ' O ' ' HB2' ' A' ' 51' ' ' ARG . 71.8 tt0 -43.63 -51.13 7.18 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.931 0.77 . . . . 0.0 110.474 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -66.07 -39.14 89.82 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.42 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.456 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 41.9 t -55.5 -59.24 5.11 Favored 'General case' 0 C--N 1.355 0.843 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.186 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 50' ' ' MET . . . . . 0.524 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 66.9 mtt -60.97 -31.96 71.52 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 122.884 0.474 . . . . 0.0 111.011 177.913 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 5.4 tmm_? -58.11 -41.94 84.65 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.57 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.433 ' HB ' ' CZ ' ' A' ' 43' ' ' PHE . 7.6 m -101.24 -51.31 3.54 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.13 12.04 37.4 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -178.529 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 54' ' ' GLY . . . . . 0.524 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.341 0.841 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.581 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.532 0.206 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' PHE . . . . . 0.507 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 2.5 p90 -104.57 -29.76 10.44 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.926 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -83.57 -35.69 24.54 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LEU . . . . . 0.559 ' HA ' ' HB2' ' A' ' 23' ' ' ALA . 4.3 mm? -80.54 -8.18 59.49 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.547 179.083 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -112.26 155.39 43.65 Favored Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.395 179.307 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -61.52 142.83 96.3 Favored 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 122.706 2.27 . . . . 0.0 113.392 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -61.56 165.35 13.61 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 123.522 2.815 . . . . 0.0 113.395 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' TYR . . . . . 0.744 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 15.1 t80 -125.57 35.18 4.77 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.623 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 32' ' ' VAL . 7.0 m -57.92 -41.69 83.22 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.093 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' GLY . . . . . 0.637 ' HA3' ' NE ' ' A' ' 37' ' ' ARG . . . 70.91 -165.17 53.14 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.318 -0.712 . . . . 0.0 113.027 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PRO . . . . . 0.466 ' HD3' HH21 ' A' ' 37' ' ' ARG . 3.0 Cg_exo -80.83 16.75 1.54 Allowed 'Trans proline' 0 C--N 1.368 1.566 0 C-N-CA 123.052 2.501 . . . . 0.0 112.824 179.433 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.77 114.86 22.78 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.624 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -142.04 83.23 1.83 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.154 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.44 -104.44 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ARG . . . . . 0.558 ' HD3' ' N ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -137.98 34.36 2.37 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.044 0.45 . . . . 0.0 112.197 -178.428 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ILE . . . . . 0.535 ' HB ' ' O ' ' A' ' 33' ' ' TYR . 23.1 mt -127.54 61.92 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-O 121.801 0.81 . . . . 0.0 109.62 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ILE . . . . . 0.947 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.5 mp -69.82 126.7 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.57 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ARG . . . . . 0.968 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 71.2 mtt180 -127.64 -179.73 5.08 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 113.032 -1.895 . . . . 0.0 108.805 -179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 19' ' ' TYR . . . . . 0.673 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.5 m-85 -111.45 153.92 25.43 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -177.835 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' PHE . . . . . 0.586 ' CE2' ' HB3' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -142.98 145.15 32.69 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 178.465 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 21' ' ' TYR . . . . . 0.482 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 44.9 t80 -101.39 119.21 38.41 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.21 93.72 5.92 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.768 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ALA . . . . . 0.559 ' HB2' ' HA ' ' A' ' 4' ' ' LEU . . . -56.9 -13.32 2.54 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.673 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 tttm -95.55 -34.65 11.95 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 118.401 0.546 . . . . 0.0 110.942 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -79.62 -31.42 41.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.914 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.6 -15.23 61.26 Favored Glycine 0 C--N 1.34 0.785 0 O-C-N 123.414 0.446 . . . . 0.0 112.999 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LEU . . . . . 0.604 HD13 ' H ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -115.55 170.64 8.27 Favored 'General case' 0 C--O 1.244 0.764 0 CA-C-O 121.141 0.496 . . . . 0.0 112.122 -179.395 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.5 t -93.55 157.64 16.09 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.154 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' GLN . . . . . 0.586 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 25.2 tt0 -144.88 130.95 19.37 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.172 -178.983 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.3 p -77.33 139.65 39.82 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PHE . . . . . 0.616 ' O ' ' N ' ' A' ' 18' ' ' ARG . 18.4 p90 -138.13 159.41 42.1 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.625 179.421 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' VAL . . . . . 0.947 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.1 t -97.89 164.52 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 123.643 0.777 . . . . 0.0 110.512 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.535 ' O ' ' HB ' ' A' ' 16' ' ' ILE . 45.3 t80 -137.49 157.21 47.04 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.693 179.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.14 -167.11 19.38 Favored Glycine 0 C--N 1.337 0.628 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.027 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.72 12.57 69.06 Favored Glycine 0 C--N 1.34 0.775 0 C-N-CA 121.609 -0.329 . . . . 0.0 113.185 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.99 -34.75 12.24 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 122.761 0.425 . . . . 0.0 112.007 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' ARG . . . . . 0.637 ' NE ' ' HA3' ' A' ' 10' ' ' GLY . 87.2 mtt-85 -132.36 150.95 52.05 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.22 0.325 . . . . 0.0 110.513 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -142.98 118.04 10.07 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.414 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.744 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 0.2 OUTLIER -148.42 174.93 11.56 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.228 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -75.97 -51.28 12.74 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.16 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASN . . . . . 0.507 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 64.7 t-20 -53.49 92.28 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.405 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ASN . . . . . 0.968 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 3.9 m-80 -157.78 109.22 2.28 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 114.559 -1.201 . . . . 0.0 108.914 177.697 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PHE . . . . . 0.673 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 0.7 OUTLIER -97.42 -168.53 1.7 Allowed 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -176.655 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.93 -68.58 0.82 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 113.242 -1.799 . . . . 0.0 112.609 178.332 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' SER . . . . . 0.45 ' HA ' ' CE2' ' A' ' 19' ' ' TYR . 52.6 m -154.43 177.35 11.26 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.268 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.32 -37.32 72.32 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.48 -54.46 46.35 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 123.356 0.41 . . . . 0.0 111.187 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -73.23 -31.73 64.32 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.603 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' CYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 45' ' ' SER . 7.6 t -58.94 -40.8 85.76 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.374 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 74.0 mtm -84.03 -34.21 24.33 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 123.627 0.579 . . . . 0.0 110.533 178.183 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -54.6 -38.14 66.42 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.705 178.889 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' THR . . . . . 0.439 ' HB ' ' HZ ' ' A' ' 43' ' ' PHE . 11.5 m -100.37 -48.04 4.71 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.57 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' CYS . . . . . 0.482 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -116.1 55.16 0.81 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -179.145 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.475 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.48 179.277 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 120.55 0.214 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.48 ' HB2' ' HA ' ' A' ' 41' ' ' ASN . 0.4 OUTLIER -129.7 52.03 2.03 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.376 0.608 . . . . 0.0 111.314 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.0 t -128.93 -51.07 1.22 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.733 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -100.58 8.44 43.44 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 123.47 0.481 . . . . 0.0 112.135 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.47 ' HB2' ' OD1' ' A' ' 41' ' ' ASN . 55.3 mm-40 -89.87 141.2 28.01 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.121 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 4.2 Cg_exo -75.7 159.37 38.88 Favored 'Trans proline' 0 C--N 1.369 1.613 0 C-N-CA 123.107 2.538 . . . . 0.0 113.085 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.587 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 58.7 Cg_endo -63.1 148.12 93.62 Favored 'Trans proline' 0 C--N 1.37 1.709 0 C-N-CA 123.518 2.812 . . . . 0.0 113.619 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -107.8 45.9 0.98 Allowed 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.39 0.614 . . . . 0.0 110.83 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.639 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 21.8 m -54.17 -48.25 71.11 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.755 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 54.66 -150.89 16.19 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-O 119.291 -0.727 . . . . 0.0 113.22 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -87.84 15.74 2.06 Favored 'Trans proline' 0 C--N 1.366 1.45 0 C-N-CA 122.968 2.446 . . . . 0.0 113.344 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -140.87 120.17 13.03 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.422 0.289 . . . . 0.0 111.541 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.752 ' HE2' ' HA ' ' A' ' 33' ' ' TYR . 2.1 tptm -179.16 108.28 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.969 1.308 . . . . 0.0 108.114 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.579 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -76.66 -141.82 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.881 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.45 ' CZ ' ' HB1' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -104.45 46.1 0.93 Allowed 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.168 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.0 mt -129.0 90.59 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 1.058 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.2 mp -76.5 144.67 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-O 121.73 0.776 . . . . 0.0 110.58 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.751 ' HG2' ' HA ' ' A' ' 44' ' ' LYS . 4.8 ttt180 -134.2 -160.32 1.04 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 113.633 -1.621 . . . . 0.0 110.237 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -132.78 147.24 52.31 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.659 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 6.2 p90 -144.97 141.94 29.39 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.57 ' CE2' ' HG2' ' A' ' 50' ' ' MET . 17.3 t80 -84.47 120.7 26.61 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.515 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 0.7 OUTLIER -97.0 95.85 8.09 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.362 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.88 -14.17 0.19 Allowed 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -178.197 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -95.91 -26.66 15.51 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 117.536 0.153 . . . . 0.0 111.214 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB3' ' HB2' ' A' ' 22' ' ' ASN . . . -85.1 -44.84 12.64 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.515 0.509 . . . . 0.0 111.689 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.69 -8.34 25.95 Favored Glycine 0 C--N 1.343 0.923 0 C-N-CA 121.25 -0.5 . . . . 0.0 113.495 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.515 ' N ' HD13 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -141.56 175.31 9.78 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.947 0.374 . . . . 0.0 111.708 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 94.4 m -94.42 102.89 14.87 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.635 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.5 tp60 -79.76 148.36 31.5 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.644 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 40.7 p -78.41 121.95 25.18 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.076 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.691 ' O ' ' N ' ' A' ' 18' ' ' ARG . 5.5 p90 -138.83 154.03 48.41 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 114.195 -1.366 . . . . 0.0 108.253 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 1.058 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 14.3 t -76.94 163.7 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 CA-C-N 118.508 0.595 . . . . 0.0 112.407 -178.071 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.752 ' HA ' ' HE2' ' A' ' 13' ' ' LYS . 55.3 t80 -117.5 146.54 43.47 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.099 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -119.12 151.16 17.72 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 120.996 -0.621 . . . . 0.0 113.213 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.16 -15.01 46.36 Favored Glycine 0 C--N 1.339 0.702 0 O-C-N 123.86 0.388 . . . . 0.0 112.733 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.94 -34.85 17.97 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 122.704 0.402 . . . . 0.0 111.693 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -97.34 -72.06 0.66 Allowed 'General case' 0 CA--C 1.536 0.411 0 O-C-N 123.233 0.333 . . . . 0.0 110.443 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 47.55 117.95 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.581 1.152 . . . . 0.0 113.888 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -131.74 -173.17 3.06 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.26 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -75.53 -47.81 25.26 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.448 -177.312 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.599 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.2 OUTLIER -69.98 76.57 0.48 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.217 0.532 . . . . 0.0 111.627 -179.523 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -154.74 128.51 8.69 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.095 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.54 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 56.9 m-85 -129.97 135.21 48.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.137 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.751 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 3.2 tppp? -80.1 -38.89 30.73 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 123.267 0.354 . . . . 0.0 111.872 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.8 m -111.87 138.53 48.35 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 123.234 0.334 . . . . 0.0 111.661 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.63 -31.62 72.85 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.709 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.4 mp0 -63.56 -56.9 12.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.347 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -68.75 -24.13 64.41 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.156 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.54 ' HA ' ' CD2' ' A' ' 43' ' ' PHE . 43.4 t -66.81 -54.86 18.2 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.659 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.57 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 96.7 mtp -73.26 -30.36 63.39 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.091 0.557 . . . . 0.0 112.218 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -74.0 -37.68 64.34 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 123.282 0.364 . . . . 0.0 111.693 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.4 m -85.91 -33.81 21.11 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 123.129 0.268 . . . . 0.0 111.436 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.496 ' HB3' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -87.02 -50.11 6.87 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 121.24 -0.184 . . . . 0.0 110.565 179.928 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -98.12 -101.15 2.16 Favored Glycine 0 C--N 1.341 0.856 0 O-C-N 123.443 0.464 . . . . 0.0 112.547 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 124.3 -54.88 0.72 Allowed Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.514 -0.374 . . . . 0.0 112.49 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.25 0 CA-C-O 118.105 -0.95 . . . . 0.0 112.308 -179.956 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.549 0.214 . . . . 0.0 111.119 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -104.85 -161.13 0.8 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.049 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 42.2 t 73.82 -47.26 0.65 Allowed 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.443 1.097 . . . . 0.0 111.826 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -98.78 -12.86 20.5 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 123.188 0.305 . . . . 0.0 111.571 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 5.8 mm-40 -97.85 147.9 33.71 Favored Pre-proline 0 CA--C 1.537 0.446 0 O-C-N 123.258 0.349 . . . . 0.0 111.04 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 3.7 Cg_exo -78.04 165.13 26.54 Favored 'Trans proline' 0 C--N 1.369 1.631 0 C-N-CA 123.264 2.643 . . . . 0.0 112.949 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.565 ' HD3' ' CD1' ' A' ' 20' ' ' PHE . 50.0 Cg_endo -60.48 161.1 21.58 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 123.492 2.795 . . . . 0.0 113.085 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.447 ' CE2' ' HD2' ' A' ' 37' ' ' ARG . 10.3 t80 -125.83 36.27 4.56 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.45 ' OG1' ' HD2' ' A' ' 31' ' ' PHE . 11.8 m -62.04 -47.79 83.16 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 178.688 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.37 -161.03 53.51 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.704 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.46 42.1 1.19 Allowed 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 123.067 2.511 . . . . 0.0 112.572 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.4 m -92.35 -66.12 0.95 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.466 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? 66.03 98.18 0.05 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.016 0.927 . . . . 0.0 111.571 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.544 ' HB1' HH21 ' A' ' 15' ' ' ARG . . . -119.03 -175.05 2.83 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.535 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.895 ' HE ' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -109.0 38.24 2.34 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.163 0.506 . . . . 0.0 111.866 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.419 ' C ' HG13 ' A' ' 32' ' ' VAL . 16.2 mt -138.52 71.41 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.384 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 1.062 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 13.1 tt -75.06 117.32 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-O 122.403 1.097 . . . . 0.0 111.48 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.761 ' N ' ' O ' ' A' ' 31' ' ' PHE . 54.4 mtt180 -100.28 -159.22 0.72 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 112.668 -2.06 . . . . 0.0 109.818 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.452 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 10.2 m-85 -125.5 164.23 20.95 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.736 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 7.1 p90 -158.13 164.31 36.74 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.894 -1.048 . . . . 0.0 108.994 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.632 ' HD1' ' SG ' ' A' ' 28' ' ' CYS . 63.1 t80 -108.9 110.28 21.56 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.641 HD21 ' HB2' ' A' ' 29' ' ' GLN . 0.2 OUTLIER -77.53 83.48 3.93 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.489 0.661 . . . . 0.0 109.916 -179.418 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 3' ' ' CYS . . . -62.31 -2.62 1.05 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.213 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -96.95 -38.07 9.95 Favored 'General case' 0 C--N 1.346 0.452 0 C-N-CA 122.359 0.263 . . . . 0.0 110.763 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -87.04 -56.01 3.57 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.016 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 153.56 -55.81 0.43 Allowed Glycine 0 C--N 1.343 0.929 0 C-N-CA 121.295 -0.478 . . . . 0.0 112.453 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 pp -96.74 -175.16 3.21 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -178.337 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.632 ' SG ' ' HD1' ' A' ' 21' ' ' TYR . 89.1 m -98.67 139.62 34.1 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.271 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.641 ' HB2' HD21 ' A' ' 22' ' ' ASN . 0.1 OUTLIER -123.38 153.64 40.09 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 123.263 0.352 . . . . 0.0 110.625 -179.713 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.674 ' HB ' HG12 ' A' ' 17' ' ' ILE . 40.4 p -85.36 120.0 26.35 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.761 ' O ' ' N ' ' A' ' 18' ' ' ARG . 4.1 p90 -108.77 163.3 13.39 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 114.263 -1.335 . . . . 0.0 107.421 177.284 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 1.062 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 41.0 t -104.39 144.25 14.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 119.546 1.066 . . . . 0.0 109.71 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.578 ' HB2' ' HD2' ' A' ' 18' ' ' ARG . 39.0 t80 -115.07 124.66 52.15 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.007 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -125.45 -168.29 12.69 Favored Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.581 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -97.28 23.9 33.79 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 121.353 -0.451 . . . . 0.0 112.936 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 21.6 p -95.5 -44.05 7.69 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.281 0.233 . . . . 0.0 111.055 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.447 ' HD2' ' CE2' ' A' ' 8' ' ' TYR . 40.2 mmt180 -133.4 169.68 16.59 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.897 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -158.66 120.96 3.6 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.031 0.532 . . . . 0.0 110.084 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -141.65 -169.1 2.82 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.326 0.584 . . . . 0.0 112.082 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -76.23 -67.61 0.67 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.93 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 57.6 t-20 -44.9 99.6 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -178.448 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.6 m-80 -151.37 139.28 19.95 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.947 178.552 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.736 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 97.7 m-85 -142.71 147.71 36.09 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.588 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -96.71 -44.04 7.28 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.643 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.4 m -133.9 165.07 25.85 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.432 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -62.36 -69.58 0.25 Allowed 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.052 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 67.7 tt0 -51.52 -37.01 47.27 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.813 0.445 . . . . 0.0 111.283 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.409 ' HA ' ' HG2' ' A' ' 51' ' ' ARG . 1.4 m-20 -69.0 -34.0 74.56 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.462 178.247 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.662 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 33.8 t -65.93 -46.19 79.15 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.005 178.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.448 ' SD ' ' SG ' ' A' ' 28' ' ' CYS . 1.4 mpt? -64.75 -52.29 57.77 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.931 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 46.0 ptt85 -64.34 -37.16 86.53 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -178.853 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 25.5 m -80.38 -31.52 37.76 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.588 ' SG ' ' CD2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -88.41 -63.18 1.34 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 119.454 -0.307 . . . . 0.0 111.502 -179.616 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.455 ' N ' ' SG ' ' A' ' 53' ' ' CYS . . . -137.15 70.65 0.49 Allowed Glycine 0 C--N 1.347 1.148 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.553 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -117.23 60.71 0.44 Allowed Glycine 0 C--N 1.337 0.62 0 C-N-CA 121.478 -0.391 . . . . 0.0 112.535 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.211 -0.899 . . . . 0.0 111.069 -179.918 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.476 0.179 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -96.14 7.74 45.62 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.028 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.535 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 46.9 t -84.05 -24.0 30.61 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.008 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.493 ' HA ' ' CB ' ' A' ' 23' ' ' ALA . 4.1 mm? -116.86 -12.53 10.75 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.651 0.594 . . . . 0.0 111.471 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.412 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 5.8 mm-40 -96.52 144.37 27.73 Favored Pre-proline 0 N--CA 1.468 0.43 0 O-C-N 123.287 0.367 . . . . 0.0 111.154 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 4.9 Cg_exo -78.7 163.18 26.67 Favored 'Trans proline' 0 C--N 1.369 1.642 0 C-N-CA 123.293 2.662 . . . . 0.0 113.052 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.513 ' HD3' ' CE1' ' A' ' 20' ' ' PHE . 62.6 Cg_endo -64.25 168.84 11.83 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 123.498 2.798 . . . . 0.0 113.084 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.537 ' CZ ' ' HD3' ' A' ' 37' ' ' ARG . 7.2 t80 -129.27 1.16 5.15 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.3 m -44.22 -13.05 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 49.46 -146.21 7.27 Favored Glycine 0 CA--C 1.535 1.327 0 N-CA-C 114.657 0.623 . . . . 0.0 114.657 177.67 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -83.43 4.72 6.84 Favored 'Trans proline' 0 C--N 1.37 1.698 0 C-N-CA 123.405 2.737 . . . . 0.0 113.487 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.4 136.61 33.79 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.1 82.74 2.04 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.867 -1.06 . . . . 0.0 109.798 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.6 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -78.57 -161.16 0.26 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.367 -1.288 . . . . 0.0 111.094 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.759 ' HE ' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -120.84 39.37 3.8 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.188 0.518 . . . . 0.0 111.358 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.551 ' HB ' ' O ' ' A' ' 33' ' ' TYR . 24.5 mt -134.97 75.66 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.061 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 1.08 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 21.2 mm -55.83 144.78 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 123.692 0.797 . . . . 0.0 110.837 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.53 HH12 ' HE3' ' A' ' 44' ' ' LYS . 14.4 mmt180 -149.11 171.63 16.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 113.679 -1.601 . . . . 0.0 110.166 -177.809 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.469 ' C ' ' HB2' ' A' ' 43' ' ' PHE . 4.3 m-85 -117.63 155.76 29.32 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 121.261 -0.176 . . . . 0.0 111.237 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.805 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 1.0 OUTLIER -146.68 152.86 39.55 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 123.643 0.589 . . . . 0.0 110.112 178.797 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.509 ' HB2' ' SG ' ' A' ' 49' ' ' CYS . 30.3 t80 -100.43 132.94 45.54 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.586 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -95.31 127.11 41.09 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.128 -0.694 . . . . 0.0 109.128 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 3' ' ' CYS . . . -94.59 14.15 21.87 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.603 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -97.03 -23.1 16.43 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.463 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -136.77 -23.25 1.2 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.264 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 97.69 -7.79 63.45 Favored Glycine 0 C--N 1.346 1.106 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.106 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.463 ' HG ' ' HB3' ' A' ' 25' ' ' ALA . 3.4 pp -87.31 144.8 26.62 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 122.757 0.423 . . . . 0.0 111.759 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.479 ' H ' ' HE1' ' A' ' 50' ' ' MET . 78.3 m -92.19 142.3 27.64 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.832 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.538 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 2.5 tm0? -124.22 145.58 49.26 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.185 0.516 . . . . 0.0 111.835 -178.056 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.413 HG22 ' CZ ' ' A' ' 19' ' ' TYR . 39.8 p -85.4 143.11 28.81 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.509 -1.223 . . . . 0.0 111.826 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.559 ' CZ ' ' HB3' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -165.13 176.13 8.76 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.9 178.343 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 1.08 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 1.3 t -92.77 -162.07 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 124.32 1.048 . . . . 0.0 111.141 -178.791 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.749 ' H ' HG12 ' A' ' 32' ' ' VAL . 65.4 t80 -174.33 144.15 0.91 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.631 1.173 . . . . 0.0 109.037 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.89 -160.55 9.59 Favored Glycine 0 C--N 1.337 0.602 0 C-N-CA 120.962 -0.637 . . . . 0.0 113.225 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -94.77 15.05 64.18 Favored Glycine 0 C--N 1.338 0.693 0 O-C-N 123.781 0.342 . . . . 0.0 113.406 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -48.03 7.47 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.537 ' HD3' ' CZ ' ' A' ' 8' ' ' TYR . 2.6 mmp_? -135.49 119.54 17.55 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.021 0.439 . . . . 0.0 111.498 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -118.46 119.38 34.4 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.635 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.405 ' HB3' ' H ' ' A' ' 40' ' ' ARG . 9.8 tmtt? -124.43 -114.87 0.29 Allowed 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.824 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.405 ' H ' ' HB3' ' A' ' 39' ' ' LYS . 24.4 mmm180 -142.39 -33.37 0.48 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 122.657 0.383 . . . . 0.0 111.306 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -66.62 101.38 0.78 Allowed 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.696 0.76 . . . . 0.0 111.45 -179.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -146.38 150.57 35.93 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 114.343 -1.299 . . . . 0.0 109.61 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.805 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 64.6 m-85 -153.36 165.35 36.05 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.811 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.53 ' HE3' HH12 ' A' ' 18' ' ' ARG . 13.8 mptt -99.02 -54.82 2.88 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.701 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.6 m -143.71 170.6 15.56 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.724 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.87 -46.79 87.9 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -52.17 -60.57 3.05 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.069 0.548 . . . . 0.0 110.941 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 52' ' ' THR . 49.0 m-20 -59.55 -53.44 58.11 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.316 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.632 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 28.5 t -40.28 -48.25 2.6 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.546 0.738 . . . . 0.0 111.961 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.479 ' HE1' ' H ' ' A' ' 28' ' ' CYS . 25.6 mmt -67.59 -47.11 70.68 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.854 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -79.3 -9.55 59.61 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 48' ' ' ASP . 40.2 m -91.67 -45.38 8.49 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.264 0.225 . . . . 0.0 110.586 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.64 -43.72 8.16 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 123.159 0.287 . . . . 0.0 110.802 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.78 -100.81 1.86 Allowed Glycine 0 C--N 1.345 1.043 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.716 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 147.42 55.28 0.02 OUTLIER Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.436 -0.412 . . . . 0.0 112.515 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.086 -179.984 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 120.55 0.214 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -124.91 -167.22 1.64 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.17 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 21' ' ' TYR . 6.6 t 72.1 -36.24 0.35 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.728 1.211 . . . . 0.0 112.552 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.496 ' CD1' ' HB2' ' A' ' 23' ' ' ALA . 13.7 tp -80.05 -10.4 59.77 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 123.419 0.45 . . . . 0.0 111.844 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -95.75 152.59 39.18 Favored Pre-proline 0 CA--C 1.536 0.435 0 O-C-N 123.395 0.435 . . . . 0.0 110.374 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.92 149.46 90.13 Favored 'Trans proline' 0 C--N 1.368 1.602 0 C-N-CA 122.603 2.202 . . . . 0.0 113.166 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.466 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 31.1 Cg_endo -55.71 138.21 80.57 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 123.648 2.899 . . . . 0.0 113.476 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.571 ' O ' ' N ' ' A' ' 10' ' ' GLY . 1.6 t80 -91.18 8.11 37.36 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.568 0.543 . . . . 0.0 111.861 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 32' ' ' VAL . 10.6 m -30.04 -18.99 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 -178.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.571 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 5.86 110.91 0.0 OUTLIER Glycine 0 C--N 1.358 1.762 0 CA-C-O 118.41 -1.217 . . . . 0.0 114.488 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -23.06 87.1 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 124.953 3.769 . . . . 0.0 115.559 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.9 m -129.9 -157.49 0.82 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.283 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -98.6 71.61 1.98 Allowed 'General case' 0 C--O 1.239 0.543 0 CA-C-O 122.209 1.004 . . . . 0.0 108.318 178.753 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.664 ' HB1' HG12 ' A' ' 32' ' ' VAL . . . -100.16 128.02 46.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 113.688 -1.596 . . . . 0.0 111.82 -179.166 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.74 20.78 2.34 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.832 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.2 mt -137.21 105.1 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.877 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.909 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 9.1 tt -81.44 134.72 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 121.545 0.688 . . . . 0.0 110.26 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.814 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 57.7 mtt180 -128.44 -176.92 3.97 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.864 -1.516 . . . . 0.0 111.105 -177.597 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.551 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.8 m-85 -122.83 148.55 45.26 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.299 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.466 ' CE2' ' HD3' ' A' ' 7' ' ' PRO . 8.9 p90 -144.3 150.6 38.12 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.357 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.652 ' HE1' ' HA2' ' A' ' 26' ' ' GLY . 3.7 t80 -86.56 125.3 33.69 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -97.4 121.94 39.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.496 ' HB2' ' CD1' ' A' ' 4' ' ' LEU . . . -80.36 5.26 15.39 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.195 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -96.55 -16.57 21.0 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.873 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.09 -39.36 1.74 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.106 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.652 ' HA2' ' HE1' ' A' ' 21' ' ' TYR . . . 114.12 -42.4 1.94 Allowed Glycine 0 C--N 1.343 0.934 0 C-N-CA 121.416 -0.421 . . . . 0.0 112.317 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.737 HD23 ' H ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -77.1 169.6 18.04 Favored 'General case' 0 C--O 1.243 0.754 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -179.127 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 62.7 m -96.05 136.14 36.9 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.167 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.551 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 18.5 mt-30 -106.15 156.17 18.71 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 123.746 0.654 . . . . 0.0 111.652 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.523 HG22 ' CE1' ' A' ' 19' ' ' TYR . 47.8 p -92.26 129.44 38.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.398 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.474 ' C ' HG13 ' A' ' 17' ' ' ILE . 3.1 p90 -142.83 138.76 30.56 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.423 -0.808 . . . . 0.0 108.968 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.909 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 26.0 t -88.7 103.79 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 122.889 0.475 . . . . 0.0 111.74 -178.522 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -68.08 146.19 53.71 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.367 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -120.31 153.24 16.76 Favored Glycine 0 C--N 1.336 0.556 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.01 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -98.79 44.64 1.7 Allowed Glycine 0 C--N 1.336 0.575 0 C-N-CA 121.254 -0.498 . . . . 0.0 113.103 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.5 p -95.7 -36.18 11.29 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.434 ' O ' ' HB3' ' A' ' 38' ' ' ALA . 88.4 mtt-85 -128.17 -67.57 0.8 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 123.311 0.382 . . . . 0.0 111.394 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 37' ' ' ARG . . . 96.36 132.91 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.093 1.357 . . . . 0.0 110.056 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -129.16 -112.17 0.27 Allowed 'General case' 0 CA--C 1.548 0.897 0 O-C-N 123.563 0.539 . . . . 0.0 111.772 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -151.67 -35.42 0.13 Allowed 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 64.5 t-20 -76.96 94.71 4.0 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.087 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.814 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 6.5 m-80 -157.86 125.01 5.05 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.501 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.546 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 82.1 m-85 -132.51 101.54 5.36 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -65.51 -13.29 58.57 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.3 m -131.07 140.3 50.02 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.638 0.256 . . . . 0.0 111.271 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.74 -48.0 76.2 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.13 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -47.72 -59.16 3.5 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 124.008 0.818 . . . . 0.0 110.281 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -63.68 -36.74 84.86 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.625 0.37 . . . . 0.0 111.18 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.705 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 51.0 t -56.41 -60.48 3.46 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 123.594 0.558 . . . . 0.0 110.758 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.0 mtt -63.56 -36.89 85.3 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.5 ttt85 -67.39 -38.46 84.74 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 16.9 m -79.07 -49.72 12.21 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 122.879 0.112 . . . . 0.0 111.084 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.705 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -80.92 -58.59 3.02 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.653 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -86.92 45.44 3.43 Favored Glycine 0 C--N 1.346 1.107 0 C-N-CA 120.906 -0.664 . . . . 0.0 113.23 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -132.2 -69.3 0.09 OUTLIER Glycine 0 C--N 1.337 0.624 0 C-N-CA 121.487 -0.387 . . . . 0.0 112.508 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.129 179.997 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.503 0.192 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -123.64 -148.44 0.4 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.197 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.494 ' SG ' ' HB3' ' A' ' 21' ' ' TYR . 34.0 t 70.45 -14.06 0.43 Allowed 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 124.299 1.039 . . . . 0.0 112.638 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.499 HD13 ' CE2' ' A' ' 21' ' ' TYR . 19.1 tp -92.93 42.7 1.11 Allowed 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.533 0.682 . . . . 0.0 111.088 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.45 ' HB3' ' NZ ' ' A' ' 39' ' ' LYS . 61.1 mp0 -129.98 144.92 55.03 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.966 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -71.45 153.88 60.68 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 122.887 2.391 . . . . 0.0 112.804 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.442 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 36.4 Cg_endo -57.83 133.7 57.82 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 123.458 2.772 . . . . 0.0 113.265 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -105.17 13.27 30.92 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.01 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 12' ' ' CYS . 7.1 m -46.01 -24.15 0.39 Allowed 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.412 0.685 . . . . 0.0 112.702 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 53.47 -141.53 30.98 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-O 119.482 -0.621 . . . . 0.0 114.351 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.489 ' HD2' ' HE ' ' A' ' 37' ' ' ARG . 6.3 Cg_exo -79.25 -4.48 13.79 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 123.296 2.664 . . . . 0.0 113.218 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.522 ' O ' HG22 ' A' ' 9' ' ' THR . 0.1 OUTLIER -86.01 141.27 29.61 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 179.712 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.01 85.93 2.21 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.647 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.433 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -78.01 -167.51 1.03 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 114.569 -1.196 . . . . 0.0 111.498 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.755 ' HD3' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -119.43 34.34 5.26 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 121.178 0.513 . . . . 0.0 111.45 -179.073 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.3 mt -132.29 78.36 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.44 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 1.045 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.0 mp -65.28 145.9 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-O 121.454 0.645 . . . . 0.0 109.669 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.711 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 65.4 mtt180 -148.19 168.81 21.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.726 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.534 ' CE1' HG22 ' A' ' 30' ' ' THR . 1.6 m-85 -112.85 148.4 34.98 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.596 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 4.8 p90 -141.49 152.77 44.47 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.449 1.093 . . . . 0.0 109.435 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.551 ' HE1' ' HA2' ' A' ' 26' ' ' GLY . 7.5 t80 -83.68 144.45 29.38 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -123.07 122.38 38.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.474 ' HB2' HD11 ' A' ' 4' ' ' LEU . . . -79.75 10.57 3.94 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.686 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -96.56 -22.25 17.18 Favored 'General case' 0 C--N 1.346 0.444 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.52 ' O ' HD23 ' A' ' 27' ' ' LEU . . . -133.0 -11.6 2.93 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.075 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.551 ' HA2' ' HE1' ' A' ' 21' ' ' TYR . . . 86.8 -39.63 3.09 Favored Glycine 0 C--N 1.345 1.047 0 C-N-CA 121.555 -0.355 . . . . 0.0 113.291 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.604 HD23 ' H ' ' A' ' 27' ' ' LEU . 0.4 OUTLIER -76.51 178.25 6.78 Favored 'General case' 0 C--O 1.244 0.8 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.3 m -102.27 151.01 22.73 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.985 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.596 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 53.7 tp60 -116.45 158.62 23.26 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.716 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.534 HG22 ' CE1' ' A' ' 19' ' ' TYR . 39.9 p -94.0 126.49 39.25 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.791 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.593 ' O ' ' N ' ' A' ' 18' ' ' ARG . 2.7 p90 -145.18 140.29 27.82 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.055 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 1.045 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -89.08 101.26 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 C-N-CA 123.45 0.7 . . . . 0.0 112.526 -178.167 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -73.71 148.54 42.57 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.234 178.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -140.78 -172.97 13.23 Favored Glycine 0 C--N 1.338 0.641 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.34 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -94.5 1.58 66.68 Favored Glycine 0 C--N 1.34 0.767 0 O-C-N 123.767 0.334 . . . . 0.0 113.266 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -37.71 19.28 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.489 ' HE ' ' HD2' ' A' ' 11' ' ' PRO . 88.6 mtt-85 -137.05 111.85 8.82 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.936 0.398 . . . . 0.0 111.101 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -93.85 144.01 25.82 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.918 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.45 ' NZ ' ' HB3' ' A' ' 5' ' ' GLU . 4.6 tmtp? -134.78 -128.04 0.16 Allowed 'General case' 0 CA--C 1.55 0.946 0 O-C-N 123.464 0.477 . . . . 0.0 110.744 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 78.2 mtm180 -144.28 -32.38 0.43 Allowed 'General case' 0 C--N 1.351 0.667 0 CA-C-N 118.185 0.448 . . . . 0.0 112.146 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -89.43 102.02 14.7 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.416 0.627 . . . . 0.0 111.363 -179.066 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.711 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 69.7 m-80 -144.64 116.92 8.46 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.862 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.431 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 70.3 m-85 -138.79 108.06 6.1 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.528 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -62.97 -16.81 60.9 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 60.0 p -130.98 136.68 48.76 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 120.731 0.3 . . . . 0.0 111.28 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.437 ' HB2' ' CE2' ' A' ' 19' ' ' TYR . . . -60.83 -43.12 98.69 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.444 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -48.6 -61.75 1.86 Allowed 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.857 0.723 . . . . 0.0 110.908 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -61.8 -38.24 87.38 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 122.433 0.293 . . . . 0.0 111.176 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.489 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 47.0 t -54.49 -60.04 3.88 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 123.653 0.596 . . . . 0.0 110.754 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.638 ' HB3' ' HA3' ' A' ' 55' ' ' GLY . 68.4 mtt -60.98 -40.5 93.69 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.061 0.545 . . . . 0.0 112.103 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -65.23 -30.72 71.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.407 HG21 ' HZ ' ' A' ' 43' ' ' PHE . 21.3 m -82.46 -50.3 9.01 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 122.921 0.138 . . . . 0.0 110.848 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -86.98 -58.98 2.39 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 150.08 100.91 0.22 Allowed Glycine 0 C--N 1.342 0.869 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.464 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLY . . . . . 0.638 ' HA3' ' HB3' ' A' ' 50' ' ' MET . . . -97.29 -48.1 2.08 Favored Glycine 0 C--N 1.337 0.623 0 C-N-CA 121.523 -0.37 . . . . 0.0 112.81 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.147 179.972 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 45.4 p30 . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 120.493 0.187 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -124.33 175.01 7.35 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.402 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.574 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 11.7 t 70.5 -15.67 0.35 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 124.48 1.112 . . . . 0.0 113.193 179.419 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.5 -14.25 59.0 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -100.41 155.66 36.12 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.198 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.21 165.28 5.61 Favored 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 122.809 2.339 . . . . 0.0 112.827 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.571 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 28.9 Cg_endo -55.3 134.17 62.29 Favored 'Trans proline' 0 C--N 1.376 1.98 0 C-N-CA 123.318 2.679 . . . . 0.0 113.172 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.563 ' HD2' ' HB3' ' A' ' 39' ' ' LYS . 3.6 t80 -87.1 22.02 2.18 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 123.505 0.503 . . . . 0.0 112.057 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.645 HG23 HG12 ' A' ' 32' ' ' VAL . 20.2 m -50.17 -31.38 13.48 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.076 0.55 . . . . 0.0 111.287 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 37.87 -133.29 1.25 Allowed Glycine 0 C--N 1.352 1.454 0 O-C-N 124.126 0.891 . . . . 0.0 114.026 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -83.32 3.93 7.41 Favored 'Trans proline' 0 C--N 1.366 1.486 0 C-N-CA 123.062 2.508 . . . . 0.0 112.51 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.7 m -97.27 140.96 30.97 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.16 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -148.58 85.87 1.51 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.261 0.553 . . . . 0.0 110.444 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.421 ' O ' HG21 ' A' ' 32' ' ' VAL . . . -91.36 -171.4 2.93 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.999 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.19 35.82 3.13 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.158 0.504 . . . . 0.0 112.035 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 17.4 mt -135.11 95.01 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.566 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 1.042 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.9 mp -93.87 138.86 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 121.74 0.781 . . . . 0.0 110.017 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.796 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 31.6 mtt180 -127.38 -153.19 0.55 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 113.497 -1.683 . . . . 0.0 109.546 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 3.4 m-85 -116.4 170.7 8.35 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.509 0.595 . . . . 0.0 112.262 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.646 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 9.3 p90 -159.52 167.76 27.82 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.571 1.169 . . . . 0.0 110.362 176.5 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.612 ' CD2' ' HB2' ' A' ' 53' ' ' CYS . 5.2 t80 -106.65 102.05 11.46 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.43 86.48 3.81 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.717 0.77 . . . . 0.0 109.095 178.616 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.432 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . . . -71.12 0.73 7.03 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.605 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.8 ttpt -95.02 -34.15 12.45 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.32 -49.01 6.16 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.17 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 145.38 -57.76 0.52 Allowed Glycine 0 C--N 1.343 0.963 0 O-C-N 123.452 0.47 . . . . 0.0 112.853 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 pp -89.88 -175.4 4.59 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.3 m -99.59 136.76 39.05 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.666 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.646 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 20.9 tt0 -111.05 -151.29 0.48 Allowed 'General case' 0 C--O 1.243 0.744 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.612 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 19' ' ' TYR . 34.1 p -138.69 135.35 34.72 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-N 118.789 0.722 . . . . 0.0 111.468 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.719 ' O ' ' N ' ' A' ' 18' ' ' ARG . 1.3 p90 -133.87 165.55 24.73 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.777 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 1.042 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.2 p -78.16 -163.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 C-N-CA 123.398 0.679 . . . . 0.0 111.533 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.724 ' H ' HG22 ' A' ' 32' ' ' VAL . 64.7 t80 -169.31 113.37 0.53 Allowed 'General case' 0 C--O 1.238 0.45 0 C-N-CA 124.145 0.978 . . . . 0.0 108.983 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -117.87 160.65 13.66 Favored Glycine 0 C--N 1.334 0.424 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.585 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -88.25 44.75 3.22 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 121.487 -0.387 . . . . 0.0 112.368 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.5 p -95.27 -49.15 5.6 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.478 0.311 . . . . 0.0 111.207 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -130.99 -37.34 1.29 Allowed 'General case' 0 N--CA 1.467 0.42 0 O-C-N 123.288 0.368 . . . . 0.0 111.485 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 53.86 113.65 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.123 0.969 . . . . 0.0 112.861 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.563 ' HB3' ' HD2' ' A' ' 8' ' ' TYR . 5.0 pttt -124.75 166.13 16.73 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.804 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -83.34 57.45 4.0 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 60.1 t-20 -148.58 92.82 2.05 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.664 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.796 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 7.4 m-80 -156.9 143.97 18.69 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.2 178.498 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.483 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 31.3 m-85 -136.65 147.21 46.74 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -96.76 -43.38 7.55 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.576 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.6 m -127.46 158.63 36.86 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.44 -59.6 3.83 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.778 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -48.62 -39.96 25.93 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.317 0.647 . . . . 0.0 111.64 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -74.43 -34.87 63.34 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.997 178.228 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.483 ' HA ' ' CD2' ' A' ' 43' ' ' PHE . 45.2 t -67.75 -23.74 65.27 Favored 'General case' 0 C--N 1.349 0.556 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.692 177.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.621 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 94.3 mtp -83.71 -51.86 6.9 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -49.18 -38.47 25.95 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.057 179.058 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.2 m -92.5 -49.78 5.95 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.187 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.612 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 1.6 p -128.34 65.25 1.4 Allowed 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.621 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . -168.9 73.88 0.13 Allowed Glycine 0 C--N 1.337 0.614 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.438 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.68 76.67 0.03 OUTLIER Glycine 0 C--N 1.338 0.641 0 C-N-CA 121.456 -0.402 . . . . 0.0 112.499 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.128 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.583 0.23 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -119.65 175.5 5.83 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.361 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.473 ' HB2' ' CE1' ' A' ' 43' ' ' PHE . 22.9 t 71.6 -37.31 0.39 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.647 1.179 . . . . 0.0 112.955 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 mp -82.71 -10.61 58.83 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -90.72 157.04 44.46 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.659 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -57.8 143.19 96.01 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.79 2.327 . . . . 0.0 113.181 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.54 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 39.8 Cg_endo -59.14 128.6 28.26 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 123.468 2.779 . . . . 0.0 113.824 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.653 ' HE2' ' HD3' ' A' ' 37' ' ' ARG . 81.4 t80 -129.6 100.93 5.7 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.738 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.483 HG23 ' N ' ' A' ' 34' ' ' GLY . 90.3 m -96.6 -79.65 0.45 Allowed 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.71 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.414 ' HA2' ' HD3' ' A' ' 11' ' ' PRO . . . 128.57 131.79 3.46 Favored Glycine 0 C--N 1.338 0.652 0 CA-C-O 118.83 -0.983 . . . . 0.0 110.666 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.414 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 15.1 Cg_exo -68.89 72.3 1.05 Allowed 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.704 2.27 . . . . 0.0 112.608 -179.141 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 51.2 m -126.02 -107.66 0.32 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.042 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -132.0 73.25 1.52 Allowed 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.444 0.64 . . . . 0.0 109.986 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.525 ' HB1' HG12 ' A' ' 32' ' ' VAL . . . -97.75 116.59 30.27 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.638 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -139.3 33.31 2.09 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.836 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 43.1 mt -138.46 121.35 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.362 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.654 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.1 mp -95.47 144.6 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.863 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 57.4 mtt180 -143.86 -174.74 4.34 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.492 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.592 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.1 m-85 -114.63 146.14 41.18 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.985 0.422 . . . . 0.0 112.051 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.61 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 4.0 p90 -139.76 153.96 47.28 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.023 -0.99 . . . . 0.0 108.731 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.501 ' CZ ' ' HA2' ' A' ' 26' ' ' GLY . 63.0 t80 -98.74 135.18 40.59 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -101.09 139.65 36.47 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 176.205 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -96.19 2.87 53.4 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.811 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.6 tttm -99.1 -38.1 9.07 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.53 -25.46 12.76 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.879 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.501 ' HA2' ' CZ ' ' A' ' 21' ' ' TYR . . . 67.02 53.18 28.01 Favored Glycine 0 C--N 1.348 1.244 0 C-N-CA 121.341 -0.457 . . . . 0.0 112.637 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 pp -153.17 164.71 37.57 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 122.688 0.395 . . . . 0.0 111.012 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 92.3 m -99.51 109.2 21.76 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.15 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.592 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -97.64 157.64 15.93 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.708 -178.852 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.519 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 34.6 p -87.78 130.09 34.97 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.517 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.61 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 7.5 p90 -152.36 152.64 32.32 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.214 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.654 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.1 t -77.44 161.38 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 C-N-CA 123.628 0.771 . . . . 0.0 112.545 -177.898 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.648 ' OH ' ' HB1' ' A' ' 38' ' ' ALA . 12.3 t80 -132.1 143.1 49.77 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.571 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.483 ' N ' HG23 ' A' ' 9' ' ' THR . . . -100.09 -161.1 28.47 Favored Glycine 0 C--N 1.337 0.597 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.113 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -144.06 3.26 1.47 Allowed Glycine 0 C--N 1.341 0.818 0 C-N-CA 121.139 -0.553 . . . . 0.0 114.094 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 25.7 p -84.24 -53.5 5.45 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.461 0.63 . . . . 0.0 110.534 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.653 ' HD3' ' HE2' ' A' ' 8' ' ' TYR . 54.7 ttt-85 -102.54 -84.54 0.45 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 177.583 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.648 ' HB1' ' OH ' ' A' ' 33' ' ' TYR . . . 81.91 126.18 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.347 1.059 . . . . 0.0 112.173 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -112.36 -178.12 3.33 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.616 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 88.4 mtm180 -91.92 6.47 46.09 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.474 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.459 ' OD1' ' HA ' ' A' ' 3' ' ' CYS . 52.5 t-20 -96.5 76.51 2.9 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.032 0.444 . . . . 0.0 110.769 179.857 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.863 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 7.7 m120 -156.94 134.23 10.54 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.199 178.571 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.569 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 32.4 m-85 -134.24 105.5 6.67 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.293 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -73.27 -4.61 34.2 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.9 m -131.15 135.05 47.12 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 120.753 0.311 . . . . 0.0 111.512 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.52 -43.52 84.99 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.411 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -50.91 -56.19 13.54 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 123.667 0.605 . . . . 0.0 111.279 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -64.91 -48.93 72.39 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 116.682 -0.236 . . . . 0.0 110.443 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.568 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 43.1 t -48.02 -47.15 33.64 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 123.729 0.643 . . . . 0.0 111.336 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.19 -42.74 71.97 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.311 0.244 . . . . 0.0 111.405 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -69.5 -15.05 63.18 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.6 m -107.38 -51.88 2.85 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 122.952 0.158 . . . . 0.0 111.297 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.568 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.8 OUTLIER -111.11 18.33 19.5 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -178.967 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -111.05 -79.03 0.99 Allowed Glycine 0 C--N 1.34 0.798 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.478 178.681 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.1 98.56 0.96 Allowed Glycine 0 C--N 1.337 0.585 0 C-N-CA 121.474 -0.393 . . . . 0.0 112.479 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.299 -0.858 . . . . 0.0 111.054 -179.963 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.511 0.196 . . . . 0.0 111.158 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.551 ' CD2' ' HB3' ' A' ' 40' ' ' ARG . 3.7 p90 -111.18 149.27 31.17 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.125 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.5 t 175.35 -39.52 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.255 0.622 . . . . 0.0 110.864 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.826 HD11 ' HA ' ' A' ' 56' ' ' ALA . 6.1 mp -87.43 17.78 4.28 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 123.402 0.439 . . . . 0.0 111.862 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.464 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 5.8 mm-40 -96.16 122.52 57.81 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.077 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 2.8 Cg_exo -76.71 165.62 28.45 Favored 'Trans proline' 0 C--N 1.368 1.577 0 C-N-CA 123.062 2.508 . . . . 0.0 112.558 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.595 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 28.3 Cg_endo -55.08 135.63 69.63 Favored 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 123.372 2.715 . . . . 0.0 113.386 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.407 ' C ' ' H ' ' A' ' 10' ' ' GLY . 2.7 t80 -95.95 28.67 3.03 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.972 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.646 HG23 HG11 ' A' ' 32' ' ' VAL . 14.1 m -49.65 -4.86 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . -27.09 131.35 0.04 OUTLIER Glycine 0 N--CA 1.477 1.399 0 CA-C-O 118.219 -1.323 . . . . 0.0 112.42 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -16.91 77.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.076 1 C-N-CA 125.664 4.243 . . . . 0.0 116.013 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.6 m -134.09 176.52 8.51 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.358 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -87.27 55.44 3.54 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.891 0.853 . . . . 0.0 109.941 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.65 ' HA ' ' HA2' ' A' ' 34' ' ' GLY . . . -80.95 113.44 19.16 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.857 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.689 ' O ' HG13 ' A' ' 16' ' ' ILE . 5.8 tpm_? -133.71 33.33 3.49 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.723 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.689 HG13 ' O ' ' A' ' 15' ' ' ARG . 31.4 mt -154.94 113.83 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.43 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 1.048 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.8 mp -91.42 115.63 30.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 122.312 1.053 . . . . 0.0 109.902 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.734 ' N ' ' O ' ' A' ' 31' ' ' PHE . 2.2 mmp_? -100.8 -156.12 0.54 Allowed 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 112.428 -2.169 . . . . 0.0 110.081 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 4.8 m-85 -123.75 166.7 15.11 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.822 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 8.4 p90 -162.91 170.96 17.34 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.168 176.337 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.633 ' HB2' ' SG ' ' A' ' 49' ' ' CYS . 0.8 OUTLIER -115.74 107.91 15.67 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.479 0.312 . . . . 0.0 111.408 -178.852 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.5 ' C ' ' H ' ' A' ' 24' ' ' LYS . 24.0 m120 -76.49 97.55 4.36 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-O 121.451 0.643 . . . . 0.0 112.064 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.464 ' CB ' ' HG ' ' A' ' 4' ' ' LEU . . . -76.62 24.07 0.15 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.881 177.912 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.5 ' H ' ' C ' ' A' ' 22' ' ' ASN . 12.7 tmtt? -98.73 -39.95 8.39 Favored 'General case' 0 C--N 1.35 0.624 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 177.466 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 -51.75 2.84 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.422 -1.263 . . . . 0.0 109.988 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.2 -35.18 1.59 Allowed Glycine 0 C--N 1.348 1.247 0 C-N-CA 121.246 -0.502 . . . . 0.0 112.972 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 pp -87.68 169.28 12.26 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 94.7 m -98.84 139.91 33.81 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.386 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 23.5 mt-30 -132.73 158.76 41.57 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 123.466 0.479 . . . . 0.0 110.98 179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 19' ' ' TYR . 45.1 p -85.65 121.44 28.33 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.412 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.734 ' O ' ' N ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -113.54 178.81 4.15 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 176.682 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 1.048 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.3 p -91.4 -159.16 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 118.794 0.724 . . . . 0.0 110.897 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.785 ' H ' HG22 ' A' ' 32' ' ' VAL . 77.2 t80 -173.49 111.34 0.19 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.514 1.125 . . . . 0.0 108.564 177.914 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.65 ' HA2' ' HA ' ' A' ' 14' ' ' ALA . . . -92.59 163.26 27.2 Favored Glycine 0 C--N 1.336 0.571 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.743 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.31 26.42 11.83 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 121.372 -0.442 . . . . 0.0 113.133 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -95.59 -51.02 4.71 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 122.185 0.194 . . . . 0.0 111.072 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 -145.18 139.8 27.49 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.317 0.385 . . . . 0.0 111.441 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -99.69 118.63 36.61 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.769 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.76 -171.46 2.06 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.236 0.541 . . . . 0.0 111.078 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.551 ' HB3' ' CD2' ' A' ' 2' ' ' PHE . 40.1 mmt180 -82.38 -74.5 0.34 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.428 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.464 ' HB2' ' HB2' ' A' ' 5' ' ' GLU . 49.6 t-20 -51.71 101.94 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -148.67 136.19 20.46 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 114.022 -1.445 . . . . 0.0 109.311 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.822 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 59.4 m-85 -138.17 150.07 46.44 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.572 ' HG3' ' NH1' ' A' ' 18' ' ' ARG . 0.7 OUTLIER -97.23 -46.02 6.29 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 114.684 -1.144 . . . . 0.0 111.922 -179.594 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.496 ' HB2' ' OD2' ' A' ' 48' ' ' ASP . 52.9 m -133.3 168.09 19.21 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.199 0.312 . . . . 0.0 111.603 -179.174 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.439 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -63.25 -64.69 0.83 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.875 0.47 . . . . 0.0 111.814 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.474 ' O ' ' HD2' ' A' ' 51' ' ' ARG . 97.9 mt-10 -53.17 -34.75 58.23 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.809 0.444 . . . . 0.0 111.836 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.496 ' OD2' ' HB2' ' A' ' 45' ' ' SER . 54.8 m-20 -73.52 -33.32 64.7 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.269 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.661 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 33.9 t -63.84 -47.55 80.32 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.914 178.454 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.413 ' HB3' ' NH2' ' A' ' 51' ' ' ARG . 74.7 mtm -69.6 -48.22 60.87 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.478 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.474 ' HD2' ' O ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -64.17 -30.41 71.47 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.421 ' HB ' ' HE1' ' A' ' 43' ' ' PHE . 31.0 m -90.69 -32.0 16.36 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.48 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.56 ' HB3' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -80.85 -51.95 8.03 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 117.856 0.298 . . . . 0.0 111.008 -179.782 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 97.61 -51.54 1.36 Allowed Glycine 0 C--N 1.344 0.983 0 C-N-CA 121.358 -0.449 . . . . 0.0 112.61 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.9 95.46 2.4 Favored Glycine 0 C--N 1.336 0.568 0 C-N-CA 121.389 -0.434 . . . . 0.0 112.535 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . 0.826 ' HA ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 N--CA 1.483 1.194 0 C-N-CA 124.058 0.943 . . . . 0.0 112.348 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.598 0.237 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -138.52 -32.22 0.71 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.397 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.9 t -77.25 -20.3 55.37 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.855 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.0 pp -88.05 23.78 2.0 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 120.952 0.406 . . . . 0.0 111.874 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -96.01 155.31 38.42 Favored Pre-proline 0 CA--C 1.537 0.447 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.784 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.3 141.45 81.94 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.675 2.25 . . . . 0.0 113.452 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.527 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 29.1 Cg_endo -54.81 133.87 59.86 Favored 'Trans proline' 0 C--N 1.372 1.766 0 C-N-CA 123.968 3.112 . . . . 0.0 114.029 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -135.54 103.53 5.49 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.592 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.678 HG23 ' HA ' ' A' ' 33' ' ' TYR . 28.5 m -96.49 -78.06 0.47 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.26 146.81 9.38 Favored Glycine 0 C--N 1.342 0.898 0 CA-C-O 119.117 -0.824 . . . . 0.0 111.636 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.515 ' HD2' HH22 ' A' ' 37' ' ' ARG . 7.9 Cg_exo -72.35 68.9 3.4 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.882 2.388 . . . . 0.0 112.247 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.9 m -124.9 -152.8 0.53 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.827 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -87.25 57.65 4.58 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.834 0.826 . . . . 0.0 110.182 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.622 ' HA ' ' HA2' ' A' ' 34' ' ' GLY . . . -85.26 116.17 23.45 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.697 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.502 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 3.4 ppt_? -142.16 21.77 2.08 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.046 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.5 mt -131.96 116.05 29.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.223 -178.974 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.863 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.7 mp -92.83 106.68 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 122.267 1.032 . . . . 0.0 109.355 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.617 ' N ' ' O ' ' A' ' 31' ' ' PHE . 51.2 mtt180 -98.2 174.58 6.44 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 112.825 -1.989 . . . . 0.0 110.955 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.53 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 1.5 m-85 -110.73 152.11 26.96 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.625 0.25 . . . . 0.0 111.093 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.587 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 2.4 p90 -139.83 157.46 45.68 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.592 ' CZ ' ' HA2' ' A' ' 26' ' ' GLY . 80.9 t80 -90.71 129.83 36.76 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.734 0.302 . . . . 0.0 111.366 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.612 ' HB2' HD13 ' A' ' 27' ' ' LEU . 3.2 m120 -96.58 127.66 42.77 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.31 11.79 20.24 Favored 'General case' 0 C--O 1.239 0.526 0 O-C-N 123.416 0.447 . . . . 0.0 111.981 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -97.42 -25.04 15.34 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.651 0.262 . . . . 0.0 110.916 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.894 ' HB3' HD12 ' A' ' 27' ' ' LEU . . . -138.38 -27.37 0.87 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.731 -178.719 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.592 ' HA2' ' CZ ' ' A' ' 21' ' ' TYR . . . 99.09 8.66 53.45 Favored Glycine 0 C--N 1.344 1.009 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.944 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.894 HD12 ' HB3' ' A' ' 25' ' ' ALA . 0.0 OUTLIER -96.51 151.21 19.79 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.581 0.229 . . . . 0.0 111.344 -179.634 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 87.3 m -93.56 110.26 21.85 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.36 178.733 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.587 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 33.1 tt0 -88.0 159.14 18.42 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.048 -177.549 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.44 HG22 ' CE1' ' A' ' 19' ' ' TYR . 35.5 p -96.32 128.69 43.48 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.442 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.617 ' O ' ' N ' ' A' ' 18' ' ' ARG . 7.7 p90 -152.2 152.22 31.97 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.643 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.863 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -78.33 174.28 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 C-N-CA 123.491 0.717 . . . . 0.0 111.982 -177.824 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.678 ' HA ' HG23 ' A' ' 9' ' ' THR . 48.0 t80 -155.99 139.5 15.89 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.352 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.622 ' HA2' ' HA ' ' A' ' 14' ' ' ALA . . . -102.59 -55.0 0.85 Allowed Glycine 0 C--N 1.338 0.685 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.187 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 98.36 27.37 8.7 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.527 -0.368 . . . . 0.0 113.319 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.6 p -95.79 -43.07 8.03 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.28 0.232 . . . . 0.0 111.545 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.515 HH22 ' HD2' ' A' ' 11' ' ' PRO . 84.4 mtm-85 -116.03 8.87 14.68 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 123.357 0.411 . . . . 0.0 111.644 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 12.2 118.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -92.7 -124.69 0.09 Allowed 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.721 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -140.46 -34.74 0.52 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 118.35 0.523 . . . . 0.0 111.47 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 63.5 t-20 -83.81 96.92 8.91 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.004 0.43 . . . . 0.0 111.789 -179.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.582 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 6.4 m-80 -154.92 118.48 4.53 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.271 177.803 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.53 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 28.8 m-85 -137.96 105.69 5.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.726 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -76.36 2.45 13.45 Favored 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.5 m -135.77 132.12 36.37 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.222 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.69 -45.48 89.84 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.392 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -48.39 -55.25 11.28 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.426 0.69 . . . . 0.0 111.516 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -66.15 -45.63 80.32 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 122.449 0.3 . . . . 0.0 110.749 178.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.425 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 44.7 t -47.06 -50.38 19.75 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 123.803 0.689 . . . . 0.0 111.393 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 94.9 mtp -77.38 -35.72 54.14 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.638 0.375 . . . . 0.0 111.973 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -62.47 -28.69 69.99 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 9.8 m -104.09 -52.19 2.99 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 123.196 0.31 . . . . 0.0 110.944 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.425 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -99.45 19.71 15.12 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.31 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.34 75.84 0.31 Allowed Glycine 0 C--N 1.342 0.874 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.433 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -91.59 -54.55 1.92 Allowed Glycine 0 C--N 1.337 0.607 0 C-N-CA 121.554 -0.355 . . . . 0.0 112.772 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.332 -0.842 . . . . 0.0 111.196 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.534 ' N ' HH22 ' A' ' 40' ' ' ARG . 47.1 t0 . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.521 0.2 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.421 ' HD1' ' SG ' ' A' ' 3' ' ' CYS . 12.3 p90 -130.94 -171.19 2.51 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.936 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 67.8 m 72.54 -51.56 0.7 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.379 1.071 . . . . 0.0 112.698 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 57.6 mt -79.35 -11.96 59.93 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -95.04 146.49 31.41 Favored Pre-proline 0 CA--C 1.535 0.398 0 O-C-N 123.18 0.3 . . . . 0.0 110.388 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.17 163.0 30.59 Favored 'Trans proline' 0 C--N 1.369 1.631 0 C-N-CA 122.804 2.336 . . . . 0.0 112.725 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.527 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 55.4 Cg_endo -62.44 153.11 73.13 Favored 'Trans proline' 0 C--N 1.373 1.823 0 C-N-CA 123.009 2.473 . . . . 0.0 112.448 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.738 ' HE2' ' HD3' ' A' ' 37' ' ' ARG . 2.0 t80 -88.31 22.15 2.59 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.698 HG22 ' HG3' ' A' ' 13' ' ' LYS . 7.1 m -55.6 -5.86 0.16 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.94 0.496 . . . . 0.0 111.789 178.973 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.421 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . -28.7 -90.52 0.01 OUTLIER Glycine 0 C--N 1.352 1.472 0 C-N-CA 124.253 0.93 . . . . 0.0 114.446 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -89.58 14.37 2.18 Favored 'Trans proline' 0 C--N 1.362 1.273 0 C-N-CA 122.933 2.422 . . . . 0.0 113.38 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.1 m -137.97 122.49 18.46 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 120.603 0.24 . . . . 0.0 110.883 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' A' ' 9' ' ' THR . 0.3 OUTLIER -141.53 82.66 1.83 Allowed 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.865 179.725 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.86 -170.83 2.68 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.175 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.65 38.09 1.88 Allowed 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.041 0.448 . . . . 0.0 112.133 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.5 mt -129.96 102.02 6.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.482 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.923 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 44.9 mm -91.26 144.29 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.772 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.8 ' N ' ' O ' ' A' ' 31' ' ' PHE . 4.0 ttt180 -134.8 -154.78 0.61 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.657 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.497 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 10.6 m-85 -120.33 156.36 31.47 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.292 0.496 . . . . 0.0 111.73 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.581 ' HD1' ' O ' ' A' ' 29' ' ' GLN . 0.1 OUTLIER -164.75 179.91 6.27 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 114.838 -1.073 . . . . 0.0 112.131 177.716 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.434 ' CD1' ' HB2' ' A' ' 53' ' ' CYS . 63.6 t80 -94.76 168.74 10.63 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -142.95 123.54 14.05 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 120.056 1.298 . . . . 0.0 109.953 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.63 12.99 6.13 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.603 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -98.35 -39.04 9.0 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-O 121.035 0.445 . . . . 0.0 110.477 178.789 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.06 -35.65 5.6 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.388 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.06 -39.4 2.68 Favored Glycine 0 C--N 1.341 0.85 0 O-C-N 123.48 0.488 . . . . 0.0 112.615 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.755 HD23 ' H ' ' A' ' 27' ' ' LEU . 1.2 pt? -82.59 -163.83 0.76 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.886 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 98.3 m -111.0 144.91 39.36 Favored 'General case' 0 C--N 1.347 0.469 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.357 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.581 ' O ' ' HD1' ' A' ' 20' ' ' PHE . 3.2 tp-100 -144.44 169.24 18.31 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.611 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.8 p -87.09 126.94 35.09 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -178.115 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.8 ' O ' ' N ' ' A' ' 18' ' ' ARG . 1.8 p90 -122.64 170.93 9.53 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.247 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.923 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.5 p -76.14 -161.74 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 C-N-CA 123.449 0.699 . . . . 0.0 111.35 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.743 ' H ' HG22 ' A' ' 32' ' ' VAL . 71.2 t80 179.39 117.78 0.05 OUTLIER 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.681 1.192 . . . . 0.0 108.947 178.692 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -115.53 148.51 18.91 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.34 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -86.13 46.97 3.69 Favored Glycine 0 C--N 1.34 0.755 0 C-N-CA 121.499 -0.381 . . . . 0.0 112.33 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.7 p -95.19 -46.25 6.85 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.873 0.396 . . . . 0.0 111.34 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.738 ' HD3' ' HE2' ' A' ' 8' ' ' TYR . 53.9 ttt-85 -137.9 -36.97 0.6 Allowed 'General case' 0 CA--C 1.536 0.424 0 O-C-N 123.372 0.42 . . . . 0.0 111.216 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 63.47 116.03 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.59 0.756 . . . . 0.0 111.725 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.5 mmtt -105.46 -163.67 0.96 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.423 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.534 HH22 ' N ' ' A' ' 1' ' ' ASP . 89.1 mtm180 -82.38 -76.08 0.28 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.46 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 55.4 t-20 -39.65 99.2 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -177.817 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -148.8 129.02 13.69 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 114.254 -1.339 . . . . 0.0 110.155 177.643 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.497 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 84.4 m-85 -134.19 148.02 50.84 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -98.47 -41.31 7.84 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.671 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.4 m -132.32 163.56 28.38 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.75 -55.51 29.41 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.194 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.463 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 60.4 mp0 -52.18 -28.63 18.96 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -80.38 -39.1 29.07 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.458 ' HA ' ' CE1' ' A' ' 43' ' ' PHE . 36.3 t -67.01 -24.06 65.98 Favored 'General case' 0 C--N 1.35 0.622 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.661 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.462 ' O ' ' N ' ' A' ' 54' ' ' GLY . 94.8 mtp -81.29 -55.99 4.36 Favored 'General case' 0 C--N 1.348 0.541 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.974 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 99.3 mtt180 -45.66 -37.4 5.69 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.823 0.449 . . . . 0.0 111.483 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.8 m -90.28 -58.53 2.47 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 123.483 0.489 . . . . 0.0 110.044 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -121.34 62.46 0.9 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.635 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.462 ' N ' ' O ' ' A' ' 50' ' ' MET . . . -96.92 -100.37 1.98 Allowed Glycine 0 C--N 1.336 0.537 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.574 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -140.0 48.66 0.83 Allowed Glycine 0 C--N 1.338 0.651 0 C-N-CA 121.378 -0.439 . . . . 0.0 112.65 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.265 0 C-N-CA 124.01 0.924 . . . . 0.0 112.341 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.556 0.217 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.45 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 3.0 p90 -118.66 -158.96 0.74 Allowed 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.115 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 56.0 m 73.03 -51.26 0.71 Allowed 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.346 1.058 . . . . 0.0 111.891 -179.362 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 23' ' ' ALA . 4.4 mm? -80.11 -2.2 43.47 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.727 0.411 . . . . 0.0 111.892 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -94.1 155.21 40.31 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.721 179.444 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -67.02 148.56 81.86 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.826 2.351 . . . . 0.0 112.945 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.511 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 38.3 Cg_endo -58.97 138.62 86.69 Favored 'Trans proline' 0 C--N 1.371 1.739 0 C-N-CA 123.624 2.882 . . . . 0.0 113.884 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.548 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 32.0 t80 -128.78 95.51 4.12 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.238 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.2 m -95.22 -70.8 0.7 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.563 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.2 160.23 23.39 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-O 119.288 -0.729 . . . . 0.0 112.141 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.99 64.21 6.03 Favored 'Trans proline' 0 C--N 1.369 1.644 0 C-N-CA 122.937 2.424 . . . . 0.0 112.753 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.6 m -132.0 -65.25 0.75 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.756 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.5 mptt 53.07 87.1 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.078 0.951 . . . . 0.0 112.342 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.519 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -87.28 48.92 1.72 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.255 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.2 OUTLIER 43.05 36.55 0.95 Allowed 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 178.87 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 38.1 mt -132.35 141.64 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.966 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.817 HG13 HG22 ' A' ' 32' ' ' VAL . 5.0 mp -117.85 103.33 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 122.159 0.981 . . . . 0.0 108.513 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.607 ' N ' ' O ' ' A' ' 31' ' ' PHE . 19.2 mtt180 -90.77 -169.04 2.24 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 113.106 -1.861 . . . . 0.0 111.404 -179.346 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.491 ' CE2' ' HB2' ' A' ' 46' ' ' ALA . 10.6 m-85 -124.84 158.96 32.16 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 122.334 0.254 . . . . 0.0 110.898 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.541 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 7.6 p90 -157.48 169.13 25.41 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 177.847 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.727 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 64.6 t80 -94.74 116.51 28.83 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.797 0.332 . . . . 0.0 110.955 179.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.595 HD21 ' HB2' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -98.69 83.68 3.01 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.542 179.443 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.52 ' HB2' HD13 ' A' ' 4' ' ' LEU . . . -55.68 -3.31 0.07 Allowed 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -179.082 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -96.48 -29.73 13.74 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' ALA . . . . . 0.46 ' HB3' ' HB2' ' A' ' 22' ' ' ASN . . . -89.96 -33.4 16.4 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.85 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.21 -15.9 15.4 Favored Glycine 0 C--N 1.344 0.984 0 C-N-CA 121.055 -0.593 . . . . 0.0 114.274 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 pp -154.26 -169.71 3.32 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 117.436 0.618 . . . . 0.0 111.737 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 58.8 m -81.7 139.82 34.68 Favored 'General case' 0 C--N 1.35 0.614 0 C-N-CA 122.867 0.467 . . . . 0.0 111.088 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.595 ' HB2' HD21 ' A' ' 22' ' ' ASN . 70.1 mt-30 -131.45 157.74 42.68 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.47 0.652 . . . . 0.0 112.653 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -77.81 130.14 36.32 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 113.382 -1.735 . . . . 0.0 111.766 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.607 ' O ' ' N ' ' A' ' 18' ' ' ARG . 5.9 p90 -150.93 151.59 32.37 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.299 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.817 HG22 HG13 ' A' ' 17' ' ' ILE . 20.7 t -76.59 125.19 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.833 0.853 . . . . 0.0 110.922 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.557 ' CG ' ' HD2' ' A' ' 18' ' ' ARG . 51.8 t80 -103.32 155.27 18.59 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.995 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.467 ' HA2' ' H ' ' A' ' 14' ' ' ALA . . . -105.8 -58.62 0.63 Allowed Glycine 0 C--N 1.336 0.566 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.496 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 87.33 17.95 58.05 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 121.473 -0.394 . . . . 0.0 113.004 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 25.5 p -95.05 -38.39 10.66 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 122.565 0.346 . . . . 0.0 111.245 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.409 ' HD3' ' OH ' ' A' ' 8' ' ' TYR . 59.9 ttt180 -126.92 29.68 5.6 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 123.411 0.444 . . . . 0.0 110.581 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -18.61 130.66 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -179.54 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.548 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 17.3 tptm -108.32 -132.57 0.32 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.424 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -123.35 -54.61 1.78 Allowed 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.45 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 59.9 t-20 -66.54 80.22 0.1 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.247 0.546 . . . . 0.0 111.372 -179.47 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.0 m-80 -157.69 142.88 16.9 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.238 178.536 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -133.41 154.18 50.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.963 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -97.65 -46.94 5.81 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.04 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.7 t -112.95 150.48 31.79 Favored 'General case' 0 C--O 1.241 0.625 0 O-C-N 123.486 0.492 . . . . 0.0 111.509 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.491 ' HB2' ' CE2' ' A' ' 19' ' ' TYR . . . -68.04 -38.19 82.21 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.819 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 67.4 tt0 -57.25 -42.94 82.48 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 123.499 0.499 . . . . 0.0 110.998 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -70.6 -54.74 10.85 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.203 178.651 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 14.1 t -54.64 -29.69 53.05 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.463 0.477 . . . . 0.0 111.992 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.559 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 53.0 mtt -77.9 -47.96 17.48 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 122.819 0.448 . . . . 0.0 111.105 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 99.4 mtt180 -59.82 -30.88 69.23 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.398 0.436 . . . . 0.0 111.675 179.198 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.7 m -89.24 -55.81 3.52 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.727 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 2.7 p -138.98 68.58 1.38 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.015 0.436 . . . . 0.0 111.593 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.559 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . -118.16 55.61 0.58 Allowed Glycine 0 C--N 1.339 0.727 0 C-N-CA 121.086 -0.578 . . . . 0.0 112.466 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.15 -39.52 2.44 Favored Glycine 0 C--N 1.337 0.604 0 C-N-CA 121.332 -0.461 . . . . 0.0 112.931 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.118 179.995 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 120.519 0.199 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.844 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 6.5 p90 -95.78 5.87 50.28 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.977 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.6 t -86.16 -11.26 53.04 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.797 0.439 . . . . 0.0 111.289 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.756 ' HA ' ' HB2' ' A' ' 23' ' ' ALA . 50.9 mt -125.08 -4.01 7.5 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.821 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -93.77 146.92 32.63 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.464 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -78.76 162.81 26.75 Favored 'Trans proline' 0 C--N 1.371 1.739 0 C-N-CA 123.327 2.685 . . . . 0.0 112.915 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.622 ' HD3' ' HE2' ' A' ' 20' ' ' PHE . 66.8 Cg_endo -66.35 159.75 48.68 Favored 'Trans proline' 0 C--N 1.374 1.895 0 C-N-CA 123.202 2.601 . . . . 0.0 113.727 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.51 ' HB3' ' HG2' ' A' ' 39' ' ' LYS . 54.0 t80 -137.17 83.85 2.02 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.573 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.6 m -95.86 -55.88 2.85 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.232 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.89 -159.07 29.97 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 119.303 -0.721 . . . . 0.0 112.731 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -75.48 -1.1 10.9 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 123.017 2.478 . . . . 0.0 113.058 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.13 142.9 26.99 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.634 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -140.32 89.85 2.32 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.7 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.498 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -78.03 176.1 9.48 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.824 -179.171 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.503 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 0.1 OUTLIER -105.1 25.98 9.88 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.16 0.505 . . . . 0.0 111.823 -179.045 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 12.2 mt -127.66 86.76 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.571 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 1.011 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.6 mp -82.74 145.0 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.423 0.63 . . . . 0.0 109.798 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.483 HH21 ' HB3' ' A' ' 33' ' ' TYR . 5.8 ttm-85 -139.6 -161.46 1.19 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.22 -1.355 . . . . 0.0 110.395 -177.704 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.471 ' CE1' HG22 ' A' ' 30' ' ' THR . 3.9 m-85 -119.24 165.6 14.03 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 120.626 0.25 . . . . 0.0 111.52 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.622 ' HE2' ' HD3' ' A' ' 7' ' ' PRO . 1.6 p90 -166.08 -178.27 4.57 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.397 176.556 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.533 ' HE2' ' SD ' ' A' ' 50' ' ' MET . 34.7 t80 -125.27 130.12 51.41 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.492 ' ND2' ' CE2' ' A' ' 20' ' ' PHE . 23.6 m120 -106.52 125.46 51.03 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 120.621 0.248 . . . . 0.0 110.983 179.46 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.756 ' HB2' ' HA ' ' A' ' 4' ' ' LEU . . . -82.42 15.27 2.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.208 178.633 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.3 tptp -97.18 -39.92 9.05 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.503 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -102.62 -32.46 9.88 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.999 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 97.18 9.58 55.51 Favored Glycine 0 C--N 1.34 0.797 0 CA-C-N 115.904 -0.589 . . . . 0.0 114.088 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.508 ' HA ' ' CE ' ' A' ' 50' ' ' MET . 0.6 OUTLIER -132.93 173.89 10.92 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 117.292 0.546 . . . . 0.0 111.479 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.501 ' SG ' ' HD2' ' A' ' 21' ' ' TYR . 72.8 m -90.2 133.64 34.78 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.775 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 3.8 mp0 -112.92 -162.36 0.8 Allowed 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.706 -179.13 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.471 HG22 ' CE1' ' A' ' 19' ' ' TYR . 41.3 p -131.26 126.75 36.25 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.242 0.617 . . . . 0.0 109.741 178.932 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.541 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 2.5 p90 -145.19 149.18 34.49 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.586 -178.78 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 1.011 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -73.89 179.9 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 124.462 1.105 . . . . 0.0 112.251 -176.885 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.725 ' H ' HG12 ' A' ' 32' ' ' VAL . 50.8 t80 -158.54 135.24 9.57 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.784 0.834 . . . . 0.0 109.334 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.3 -174.27 14.18 Favored Glycine 0 C--N 1.336 0.529 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.838 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -89.56 8.51 79.68 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 121.535 -0.364 . . . . 0.0 113.029 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.452 ' HB2' ' HD2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -95.11 -52.07 4.37 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 122.724 0.409 . . . . 0.0 111.88 179.758 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.452 ' HD2' ' HB2' ' A' ' 36' ' ' CYS . 1.3 mpt_? -132.24 110.48 10.65 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.05 0.452 . . . . 0.0 111.321 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -101.08 140.92 34.71 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.801 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.51 ' HG2' ' HB3' ' A' ' 8' ' ' TYR . 6.9 mmtt -115.02 -162.18 0.81 Allowed 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.46 0.475 . . . . 0.0 110.777 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.2 mmt180 -125.16 3.54 7.89 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.863 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.844 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 60.4 t-20 -119.55 100.39 7.25 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.03 0.443 . . . . 0.0 110.162 179.104 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 85.0 m-20 -134.68 132.2 38.62 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.824 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.486 ' CD1' ' HA ' ' A' ' 49' ' ' CYS . 55.0 m-85 -142.53 164.72 29.36 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.004 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -99.54 -44.84 6.01 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.166 0.186 . . . . 0.0 110.89 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -136.4 161.41 35.89 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.652 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.72 -25.72 67.61 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.647 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -59.72 -70.6 0.16 Allowed 'General case' 0 N--CA 1.474 0.742 0 O-C-N 123.413 0.445 . . . . 0.0 109.849 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -58.98 -40.16 84.0 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 122.88 0.472 . . . . 0.0 110.46 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.486 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 49.7 t -52.58 -58.16 7.69 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.758 0.661 . . . . 0.0 111.559 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.533 ' SD ' ' HE2' ' A' ' 21' ' ' TYR . 5.5 mmt -64.54 -42.24 95.85 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.7 tpp85 -70.25 -24.95 63.16 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.2 m -90.46 -40.63 11.91 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 122.995 0.185 . . . . 0.0 111.392 -179.627 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.9 -55.09 4.0 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -98.75 51.37 1.19 Allowed Glycine 0 C--N 1.342 0.902 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.625 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -164.9 63.18 0.23 Allowed Glycine 0 C--N 1.338 0.641 0 C-N-CA 121.485 -0.388 . . . . 0.0 112.504 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.061 -179.962 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.497 0.189 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.602 ' H ' ' HD1' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -130.84 -20.08 2.86 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.848 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 18.7 m -71.21 -42.76 68.56 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 122.832 0.453 . . . . 0.0 112.14 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.3 mp -79.86 -7.89 58.98 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.172 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -92.74 153.32 42.24 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.939 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -64.08 139.66 68.09 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 122.705 2.27 . . . . 0.0 113.282 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.611 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 37.6 Cg_endo -58.43 136.46 74.46 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 123.555 2.836 . . . . 0.0 114.197 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -99.45 89.12 4.07 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.217 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.5 m -96.43 -63.37 1.15 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.458 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.574 ' HA3' ' HD2' ' A' ' 37' ' ' ARG . . . 84.76 -174.93 50.29 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 119.251 -0.749 . . . . 0.0 112.338 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.584 ' HD2' ' HE ' ' A' ' 37' ' ' ARG . 3.4 Cg_exo -76.95 17.88 0.8 Allowed 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.946 2.431 . . . . 0.0 113.141 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.74 132.48 56.15 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.651 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -139.02 86.21 2.12 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.243 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.494 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -80.32 52.99 1.69 Allowed 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.973 -1.012 . . . . 0.0 112.456 -179.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.494 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.4 OUTLIER 42.13 36.2 0.67 Allowed 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 178.903 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.599 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 37.6 mt -136.46 121.6 26.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-N 116.264 -0.426 . . . . 0.0 109.86 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.765 HG13 HG22 ' A' ' 32' ' ' VAL . 4.4 mp -121.91 106.36 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 122.177 0.989 . . . . 0.0 108.799 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.66 ' HG2' ' HG2' ' A' ' 44' ' ' LYS . 33.0 mtp180 -81.88 -160.07 0.33 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 113.227 -1.806 . . . . 0.0 111.178 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.561 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 15.7 m-85 -129.81 113.5 14.77 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.907 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.573 ' HA ' ' CB ' ' A' ' 42' ' ' ASN . 4.8 p90 -106.87 -174.59 2.57 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.644 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -128.42 134.72 48.85 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.326 0.107 . . . . 0.0 110.924 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -106.57 107.4 18.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.29 -2.73 6.43 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -96.38 -34.4 11.56 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.598 0.237 . . . . 0.0 110.588 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -92.18 -41.76 10.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.0 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.08 52.04 2.66 Favored Glycine 0 C--N 1.342 0.865 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 pp -166.35 162.14 16.96 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 123.108 0.563 . . . . 0.0 111.159 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 m -94.91 111.49 23.28 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.746 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.555 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 16.8 tp60 -87.73 -163.74 0.99 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.461 -179.065 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.672 ' HB ' HG22 ' A' ' 17' ' ' ILE . 33.6 p -129.4 133.37 47.33 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.162 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.64 ' O ' ' N ' ' A' ' 18' ' ' ARG . 14.3 p90 -133.97 148.24 51.13 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.893 0.378 . . . . 0.0 111.569 -178.192 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.765 HG22 HG13 ' A' ' 17' ' ' ILE . 10.9 t -77.06 125.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 123.933 0.893 . . . . 0.0 111.791 -178.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.642 ' HE1' ' H ' ' A' ' 39' ' ' LYS . 77.5 t80 -126.53 129.16 48.08 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.108 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.427 ' HA2' ' HB3' ' A' ' 14' ' ' ALA . . . -128.04 -170.82 12.89 Favored Glycine 0 C--N 1.336 0.547 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.274 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -87.98 -9.64 70.55 Favored Glycine 0 C--N 1.341 0.811 0 O-C-N 123.735 0.314 . . . . 0.0 112.947 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.72 -34.67 27.18 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.789 0.436 . . . . 0.0 112.143 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.584 ' HE ' ' HD2' ' A' ' 11' ' ' PRO . 84.0 mtt-85 -129.58 83.87 2.17 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.504 0.668 . . . . 0.0 110.383 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -93.09 117.63 30.29 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.511 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.642 ' H ' ' HE1' ' A' ' 33' ' ' TYR . 7.4 mmtt -147.06 -174.83 4.6 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.567 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -109.75 90.2 3.24 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.611 ' ND2' ' HA ' ' A' ' 7' ' ' PRO . 0.6 OUTLIER -87.27 -68.63 0.74 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.802 -178.265 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.573 ' CB ' ' HA ' ' A' ' 20' ' ' PHE . 9.1 t-20 -150.75 -94.55 0.06 Allowed 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.488 ' CD1' ' HB3' ' A' ' 48' ' ' ASP . 66.9 m-85 -154.77 168.88 25.39 Favored 'General case' 0 C--N 1.349 0.56 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.66 ' HG2' ' HG2' ' A' ' 18' ' ' ARG . 0.6 OUTLIER -95.66 -24.56 16.5 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.288 178.587 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.487 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 26.1 t -112.53 153.68 27.1 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 120.915 0.388 . . . . 0.0 111.665 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.4 -49.63 46.97 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.442 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.2 tt0 -56.32 -34.72 66.8 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.781 0.433 . . . . 0.0 111.151 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.488 ' HB3' ' CD1' ' A' ' 43' ' ' PHE . 51.7 m-20 -72.7 -51.03 20.99 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.495 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.6 t -60.79 -30.81 70.27 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.181 178.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 63.9 mtt -75.74 -49.38 18.4 Favored 'General case' 0 C--N 1.345 0.376 0 C-N-CA 123.022 0.529 . . . . 0.0 111.434 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 48' ' ' ASP . 17.4 ptm180 -61.35 -28.01 68.91 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.8 m -92.5 -61.99 1.49 Allowed 'General case' 0 CA--C 1.549 0.91 0 O-C-N 123.281 0.363 . . . . 0.0 111.681 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -92.32 -23.71 19.18 Favored 'General case' 0 C--N 1.346 0.429 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -178.426 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -89.13 47.05 3.31 Favored Glycine 0 C--N 1.339 0.7 0 C-N-CA 120.837 -0.697 . . . . 0.0 113.043 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 173.19 -67.17 0.11 Allowed Glycine 0 C--N 1.338 0.687 0 C-N-CA 121.47 -0.395 . . . . 0.0 112.478 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.22 0 C-N-CA 124.036 0.934 . . . . 0.0 112.309 179.97 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 120.531 0.205 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.68 -21.26 1.73 Allowed 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.491 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 0.7 OUTLIER -89.29 -13.84 37.14 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.871 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.744 HD23 ' HE2' ' A' ' 21' ' ' TYR . 75.2 mt -79.2 -8.5 59.06 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -95.56 153.92 39.37 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -66.34 167.0 19.64 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 123.058 2.506 . . . . 0.0 112.776 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.525 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 55.8 Cg_endo -60.87 126.0 18.56 Favored 'Trans proline' 0 C--N 1.375 1.974 0 C-N-CA 123.151 2.568 . . . . 0.0 112.542 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.536 ' CZ ' ' HD3' ' A' ' 37' ' ' ARG . 6.6 t80 -94.01 7.24 45.84 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.412 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.414 HG23 ' H ' ' A' ' 34' ' ' GLY . 7.3 m -55.79 -11.51 1.01 Allowed 'General case' 0 N--CA 1.484 1.244 0 O-C-N 122.272 -0.267 . . . . 0.0 111.615 179.15 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 53.14 -154.79 6.23 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.581 -0.736 . . . . 0.0 113.177 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -85.06 34.17 0.5 Allowed 'Trans proline' 0 C--N 1.367 1.505 0 C-N-CA 123.004 2.469 . . . . 0.0 112.292 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 34.5 m -87.56 -66.68 0.89 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.785 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 64.9 96.4 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.847 0.859 . . . . 0.0 111.701 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.473 ' HB2' ' HA2' ' A' ' 34' ' ' GLY . . . -91.51 -141.1 0.18 Allowed 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.185 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.523 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 2.4 ppt_? -135.21 24.28 3.52 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.163 0.506 . . . . 0.0 111.748 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.492 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 33.0 mt -132.56 102.47 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.29 -179.179 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.944 HG13 HG22 ' A' ' 32' ' ' VAL . 3.2 mp -91.12 150.39 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 121.368 0.604 . . . . 0.0 109.596 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.82 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 17.1 mtt180 -145.21 -158.89 0.93 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.666 -178.492 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.608 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 5.7 m-85 -124.8 115.27 20.42 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -179.008 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.608 ' HB3' ' CD1' ' A' ' 31' ' ' PHE . 9.3 p90 -106.83 -167.65 1.31 Allowed 'General case' 0 CA--C 1.553 1.063 0 O-C-N 123.911 0.757 . . . . 0.0 109.565 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.744 ' HE2' HD23 ' A' ' 4' ' ' LEU . 0.8 OUTLIER -140.44 128.25 21.84 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.979 -0.451 . . . . 0.0 110.964 179.395 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -93.9 116.87 29.35 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 177.596 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.41 13.49 2.42 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.952 0.406 . . . . 0.0 111.31 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -97.04 -33.2 11.63 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.873 178.251 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.39 -47.49 3.38 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.157 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.08 -39.95 1.86 Allowed Glycine 0 C--N 1.345 1.043 0 C-N-CA 121.368 -0.444 . . . . 0.0 112.467 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.88 158.56 36.2 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -178.082 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.527 ' SG ' ' O ' ' A' ' 20' ' ' PHE . 35.9 t -97.49 118.86 34.93 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.047 178.769 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -104.78 -162.4 0.88 Allowed 'General case' 0 N--CA 1.466 0.329 0 O-C-N 122.989 0.181 . . . . 0.0 111.267 -177.565 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.603 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 37.3 p -114.38 154.81 27.42 Favored 'General case' 0 C--N 1.344 0.35 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.608 ' CD1' ' HB3' ' A' ' 20' ' ' PHE . 4.7 p90 -160.75 151.39 18.34 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.788 0.328 . . . . 0.0 110.796 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.944 HG22 HG13 ' A' ' 17' ' ' ILE . 5.8 t -87.07 136.49 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.31 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.43 ' OH ' ' HB1' ' A' ' 38' ' ' ALA . 44.0 t80 -102.18 111.27 23.48 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.701 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.473 ' HA2' ' HB2' ' A' ' 14' ' ' ALA . . . -100.06 151.55 19.18 Favored Glycine 0 C--N 1.336 0.551 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.661 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -92.29 34.17 4.57 Favored Glycine 0 C--N 1.338 0.663 0 C-N-CA 121.511 -0.375 . . . . 0.0 112.739 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.5 p -95.26 -39.9 9.83 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 122.47 0.308 . . . . 0.0 111.15 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.536 ' HD3' ' CZ ' ' A' ' 8' ' ' TYR . 88.2 mtt-85 -129.51 -50.16 1.17 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.467 0.48 . . . . 0.0 110.81 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . 0.43 ' HB1' ' OH ' ' A' ' 33' ' ' TYR . . . 60.18 136.38 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.111 0.964 . . . . 0.0 113.137 179.27 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -138.23 -170.77 2.88 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.397 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -104.55 52.07 0.76 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.464 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.491 ' ND2' ' HA ' ' A' ' 3' ' ' CYS . 61.1 t-20 -145.44 91.21 2.09 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.053 0.454 . . . . 0.0 110.727 179.125 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.82 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 2.8 m-80 -153.68 131.5 11.62 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.117 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.608 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 35.5 m-85 -134.61 132.2 38.74 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.834 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.758 ' HD3' ' HE ' ' A' ' 18' ' ' ARG . 3.6 mmmp? -95.48 -5.1 43.7 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.889 -179.493 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -137.79 143.25 40.99 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.104 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.24 -53.31 38.49 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.658 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -55.14 -39.16 69.13 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.265 0.626 . . . . 0.0 111.917 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -74.34 -36.65 63.66 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 35.1 t -64.29 -27.74 69.24 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 115.074 -0.967 . . . . 0.0 110.017 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 94.1 mtp -80.55 -48.56 12.55 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.754 178.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.34 -38.65 43.15 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.128 0.571 . . . . 0.0 111.243 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.0 m -99.15 -54.72 2.89 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 123.308 0.38 . . . . 0.0 110.947 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -103.37 39.92 1.5 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -178.64 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -155.31 65.72 0.32 Allowed Glycine 0 C--N 1.332 0.308 0 CA-C-N 116.202 -0.453 . . . . 0.0 112.5 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -101.46 -83.69 1.75 Allowed Glycine 0 C--N 1.337 0.608 0 C-N-CA 121.495 -0.383 . . . . 0.0 112.469 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.09 -179.941 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.742 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 54.0 m-20 . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 120.488 0.185 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.548 ' O ' ' HB2' ' A' ' 41' ' ' ASN . 24.8 p90 -123.39 -34.37 3.11 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.7 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.37 -9.25 39.4 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.407 0.442 . . . . 0.0 111.017 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.742 ' HB2' ' HB3' ' A' ' 1' ' ' ASP . 2.8 mm? -83.13 -7.43 59.63 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.298 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -94.15 157.27 37.96 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 122.485 0.314 . . . . 0.0 111.244 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -62.9 171.51 5.92 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 122.943 2.429 . . . . 0.0 112.671 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.56 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 23.2 Cg_endo -53.01 133.88 53.63 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 123.515 2.81 . . . . 0.0 113.298 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.622 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 60.4 t80 -122.55 54.06 1.22 Allowed 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.261 -178.242 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.547 HG22 ' O ' ' A' ' 12' ' ' CYS . 20.4 m -96.08 12.59 30.08 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 36.71 -143.75 0.14 Allowed Glycine 0 CA--C 1.537 1.407 0 CA-C-N 114.287 -1.324 . . . . 0.0 114.398 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -81.13 1.8 9.04 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 123.111 2.541 . . . . 0.0 113.131 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.547 ' O ' HG22 ' A' ' 9' ' ' THR . 0.1 OUTLIER -98.12 149.11 22.86 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.879 -179.769 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -146.89 96.21 2.71 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.856 0.862 . . . . 0.0 109.381 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.558 ' CB ' ' HA2' ' A' ' 34' ' ' GLY . . . -79.4 33.92 0.25 Allowed 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.897 -1.047 . . . . 0.0 113.163 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.606 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER 44.9 26.83 0.23 Allowed 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 178.408 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 14' ' ' ALA . 28.4 mt -130.22 118.43 43.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.31 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 1.058 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 34.4 mt -81.07 139.24 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-O 121.624 0.726 . . . . 0.0 110.288 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.85 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 3.8 ttt180 -131.93 -170.49 2.41 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.927 -177.919 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.3 m-85 -126.3 154.06 43.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 122.487 0.315 . . . . 0.0 111.028 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.643 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 10.3 p90 -144.75 158.6 43.72 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.376 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.428 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 12.3 t80 -90.87 120.34 31.81 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.621 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -103.48 100.22 10.07 Favored 'General case' 0 C--O 1.244 0.811 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 175.862 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.03 16.25 0.25 Allowed 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -178.974 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -96.2 -26.16 15.55 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.873 178.899 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -116.79 -38.08 3.51 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.317 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 104.82 31.35 4.52 Favored Glycine 0 C--N 1.343 0.919 0 C-N-CA 121.276 -0.488 . . . . 0.0 113.304 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.658 ' HA ' ' SD ' ' A' ' 50' ' ' MET . 0.5 OUTLIER -152.42 168.44 25.48 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.896 0.379 . . . . 0.0 111.499 179.509 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.559 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 97.7 m -94.54 127.5 40.52 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.772 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.566 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 52.5 tp60 -94.74 159.13 15.2 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.074 -179.02 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 37.0 p -94.98 124.53 39.08 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.666 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.713 ' O ' ' N ' ' A' ' 18' ' ' ARG . 3.7 p90 -155.58 160.93 40.87 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.287 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 1.058 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.5 t -72.8 -179.02 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.061 0 C-N-CA 123.294 0.638 . . . . 0.0 111.87 -177.081 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.752 ' H ' HG12 ' A' ' 32' ' ' VAL . 48.7 t80 -148.71 155.76 41.45 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.037 -178.544 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.558 ' HA2' ' CB ' ' A' ' 14' ' ' ALA . . . -142.95 140.52 9.82 Favored Glycine 0 C--N 1.335 0.526 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.767 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -78.64 2.21 68.94 Favored Glycine 0 C--N 1.341 0.823 0 C-N-CA 121.523 -0.37 . . . . 0.0 113.036 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.56 -2.92 47.45 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -133.55 -13.33 2.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -8.81 119.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.951 1.3 . . . . 0.0 114.389 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.622 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 21.7 tptm -127.65 -108.88 0.29 Allowed 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.828 -178.457 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -153.27 -32.35 0.12 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.726 0.81 . . . . 0.0 111.684 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.573 HD21 ' HB2' ' A' ' 20' ' ' PHE . 14.2 t30 -67.8 -2.56 7.38 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.033 0.933 . . . . 0.0 113.396 -178.979 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.85 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 15.8 m-20 -105.34 139.37 40.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.868 0.366 . . . . 0.0 110.716 -178.793 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.445 ' C ' ' HG2' ' A' ' 18' ' ' ARG . 5.5 m-85 -151.96 126.26 9.32 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.154 -178.049 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.76 ' HD2' ' HE ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -65.06 -39.78 93.75 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -179.774 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -99.67 128.73 45.77 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 120.987 0.422 . . . . 0.0 111.997 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.15 -41.23 99.24 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.993 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 51' ' ' ARG . 20.1 pt-20 -48.14 -55.91 9.14 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.917 0.76 . . . . 0.0 111.6 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -66.67 -45.94 77.29 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 122.457 0.303 . . . . 0.0 110.677 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.7 t -47.3 -51.91 17.8 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.809 0.693 . . . . 0.0 110.873 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.797 ' HA ' ' HE2' ' A' ' 50' ' ' MET . 8.5 mmt -74.79 -33.26 62.21 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.955 0.502 . . . . 0.0 111.573 178.677 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 67.0 ttt180 -60.13 -29.27 68.52 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.163 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.4 m -101.55 -52.94 3.1 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.493 0.496 . . . . 0.0 110.824 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.428 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -102.7 28.8 5.78 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -178.467 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -144.83 55.12 0.55 Allowed Glycine 0 N--CA 1.459 0.168 0 O-C-N 121.789 -0.569 . . . . 0.0 112.506 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 144.89 -66.14 0.44 Allowed Glycine 0 C--N 1.336 0.542 0 C-N-CA 121.47 -0.395 . . . . 0.0 112.499 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.255 0 C-N-CA 124.018 0.927 . . . . 0.0 112.305 179.993 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.3 t70 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.517 0.199 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.674 ' HB2' ' O ' ' A' ' 40' ' ' ARG . 4.3 p90 -128.28 -6.9 5.34 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.784 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.613 ' HB3' ' HB3' ' A' ' 21' ' ' TYR . 57.0 m -72.88 -50.99 20.43 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -84.16 43.53 0.95 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.427 0.632 . . . . 0.0 112.014 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -127.17 153.77 76.79 Favored Pre-proline 0 CA--C 1.537 0.476 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.446 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.95 134.77 41.32 Favored 'Trans proline' 0 C--N 1.371 1.725 0 C-N-CA 122.549 2.166 . . . . 0.0 113.396 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -57.87 141.02 95.71 Favored 'Trans proline' 0 C--N 1.372 1.776 0 C-N-CA 123.659 2.906 . . . . 0.0 113.86 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -117.06 102.38 9.28 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.463 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.0 m -95.93 -83.0 0.38 Allowed 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.73 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.14 137.64 8.29 Favored Glycine 0 C--N 1.341 0.824 0 CA-C-O 118.933 -0.926 . . . . 0.0 110.946 -178.399 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.05 83.16 0.26 Allowed 'Trans proline' 0 C--N 1.37 1.685 0 C-N-CA 122.802 2.334 . . . . 0.0 112.847 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.6 m -138.2 -167.6 2.2 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.33 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -99.7 72.5 1.75 Allowed 'General case' 0 C--O 1.238 0.476 0 CA-C-O 122.195 0.998 . . . . 0.0 108.834 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.55 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -77.45 -55.63 5.22 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 113.901 -1.5 . . . . 0.0 113.104 -177.886 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.55 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.3 OUTLIER 46.95 22.39 0.2 Allowed 'General case' 0 N--CA 1.497 1.884 0 C-N-CA 124.523 1.129 . . . . 0.0 113.792 -179.57 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.563 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 27.4 mt -135.76 142.02 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.431 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.85 HG13 HG22 ' A' ' 32' ' ' VAL . 4.5 mp -121.23 108.61 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 122.131 0.967 . . . . 0.0 108.952 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 1.024 ' HG2' ' HA ' ' A' ' 44' ' ' LYS . 27.2 mtt180 -86.5 -167.02 1.72 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 113.116 -1.857 . . . . 0.0 111.507 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.547 ' CE2' ' HB2' ' A' ' 46' ' ' ALA . 42.4 m-85 -128.91 151.16 49.95 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.633 ' HA ' ' CB ' ' A' ' 42' ' ' ASN . 3.8 p90 -147.52 155.52 41.95 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.294 0.371 . . . . 0.0 110.669 178.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.626 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 14.9 t80 -83.7 116.89 22.88 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -178.62 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.538 ' C ' ' H ' ' A' ' 24' ' ' LYS . 3.2 m120 -110.56 91.11 3.53 Favored 'General case' 0 C--O 1.246 0.902 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.253 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.02 15.86 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 120.944 0.402 . . . . 0.0 111.693 -179.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' LYS . . . . . 0.538 ' H ' ' C ' ' A' ' 22' ' ' ASN . 46.5 tptt -97.78 -37.97 9.65 Favored 'General case' 0 C--N 1.345 0.372 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.455 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.18 -15.27 18.99 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.073 179.092 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.02 13.28 72.11 Favored Glycine 0 C--N 1.349 1.265 0 N-CA-C 114.663 0.625 . . . . 0.0 114.663 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -154.3 -176.01 5.67 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 117.307 0.554 . . . . 0.0 111.378 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 31.5 m -84.6 156.38 21.61 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.989 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.626 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 56.1 tp60 -134.78 153.78 51.88 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-O 120.961 0.41 . . . . 0.0 110.395 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.419 ' HB ' ' CG2' ' A' ' 17' ' ' ILE . 35.2 p -78.26 122.97 26.41 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.43 -179.27 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.72 ' O ' ' N ' ' A' ' 18' ' ' ARG . 3.0 p90 -141.91 142.07 33.02 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.49 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.85 HG22 HG13 ' A' ' 17' ' ' ILE . 48.3 t -78.01 126.76 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 123.984 0.914 . . . . 0.0 111.462 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.491 ' O ' ' HB1' ' A' ' 14' ' ' ALA . 42.1 t80 -112.23 131.8 55.29 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.168 179.629 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.474 ' HA2' ' HB2' ' A' ' 14' ' ' ALA . . . -89.64 153.59 23.36 Favored Glycine 0 C--N 1.34 0.801 0 O-C-N 123.701 0.625 . . . . 0.0 113.238 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.31 8.89 69.62 Favored Glycine 0 C--N 1.338 0.656 0 O-C-N 123.82 0.364 . . . . 0.0 113.162 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.2 p -94.94 -43.83 7.99 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 122.503 0.321 . . . . 0.0 110.876 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.3 mtt-85 -119.27 124.47 46.78 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.942 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -111.59 138.07 48.62 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.899 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.636 ' HZ2' ' HB3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -142.98 -170.72 3.31 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.859 179.575 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' ARG . . . . . 0.674 ' O ' ' HB2' ' A' ' 2' ' ' PHE . 80.4 mmt-85 -121.62 91.31 3.49 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.56 ' O ' ' HD1' ' A' ' 2' ' ' PHE . 46.3 t30 -107.57 -52.59 2.74 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.972 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.633 ' CB ' ' HA ' ' A' ' 20' ' ' PHE . 1.1 m120 -160.82 -103.01 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.447 0.467 . . . . 0.0 110.431 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.403 ' HB2' ' HB2' ' A' ' 49' ' ' CYS . 55.0 m-85 -150.96 -173.8 4.6 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -177.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 1.024 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 12.5 tppt? -97.79 -42.24 7.68 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.688 177.741 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.5 m -108.86 155.32 20.95 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.906 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.547 ' HB2' ' CE2' ' A' ' 19' ' ' TYR . . . -68.41 -37.35 80.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.92 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -54.35 -50.94 66.27 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.701 0.4 . . . . 0.0 111.643 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -70.52 -52.33 22.56 Favored 'General case' 0 C--N 1.345 0.39 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.969 178.407 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.432 ' SG ' ' ND2' ' A' ' 42' ' ' ASN . 41.9 t -49.5 -34.59 17.48 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.187 0.595 . . . . 0.0 112.309 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.613 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 59.0 mtt -78.77 -47.16 17.32 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 122.941 0.496 . . . . 0.0 111.607 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -58.05 -33.32 68.9 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 123.799 0.687 . . . . 0.0 111.58 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.9 m -86.22 -55.16 4.05 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.626 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 2.2 p -149.61 74.25 1.22 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.059 0.457 . . . . 0.0 112.118 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.613 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . -178.59 50.74 0.09 OUTLIER Glycine 0 C--N 1.339 0.715 0 C-N-CA 121.199 -0.525 . . . . 0.0 112.728 179.179 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 160.0 46.75 0.02 OUTLIER Glycine 0 C--N 1.339 0.701 0 C-N-CA 121.444 -0.408 . . . . 0.0 112.777 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.148 179.978 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 120.505 0.193 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.469 ' HE1' ' CZ ' ' A' ' 43' ' ' PHE . 1.3 p90 -125.93 -26.06 3.51 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.044 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.555 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 24.9 t -86.67 -14.15 43.42 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.222 0.326 . . . . 0.0 111.807 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.425 HD22 ' CD2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -79.67 -8.69 59.37 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 179.966 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -95.6 157.54 35.94 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -70.58 167.73 24.66 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.85 2.366 . . . . 0.0 112.523 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.498 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 37.9 Cg_endo -58.25 132.92 51.85 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 123.257 2.638 . . . . 0.0 112.968 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -92.72 -0.53 57.26 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.7 m -40.87 -22.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.901 0.88 . . . . 0.0 113.218 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 55.65 -150.92 20.75 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-O 119.409 -0.662 . . . . 0.0 113.511 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -81.9 13.17 2.56 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 123.159 2.573 . . . . 0.0 112.484 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.5 m -84.89 154.58 22.15 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.889 -179.591 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -133.32 73.42 1.51 Allowed 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.341 0.591 . . . . 0.0 111.19 -179.345 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.697 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . . . -86.92 172.26 10.18 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.411 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.856 ' HE ' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -110.79 45.14 1.18 Allowed 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.015 0.436 . . . . 0.0 111.521 -179.414 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.3 mt -131.81 92.08 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 1.141 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.1 mp -76.24 144.25 12.07 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-O 121.565 0.697 . . . . 0.0 110.131 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.95 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 68.1 mtt180 -150.56 -178.23 6.43 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.41 -177.677 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.83 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 1.5 m-85 -123.31 152.98 40.88 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.498 ' CE2' ' HD3' ' A' ' 7' ' ' PRO . 8.1 p90 -144.76 168.7 19.58 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 124.054 0.846 . . . . 0.0 109.582 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.684 ' CD2' ' HB2' ' A' ' 53' ' ' CYS . 3.8 t80 -106.86 128.87 54.66 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.418 ' ND2' ' HB2' ' A' ' 29' ' ' GLN . 69.1 m-80 -105.97 109.95 22.07 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 175.43 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.79 21.3 0.68 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.249 0.547 . . . . 0.0 110.805 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 tppt? -96.19 -23.74 16.58 Favored 'General case' 0 C--N 1.345 0.405 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.522 178.908 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -127.52 -31.15 2.52 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.198 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.415 ' HA2' ' HE1' ' A' ' 21' ' ' TYR . . . 95.44 31.29 7.6 Favored Glycine 0 C--N 1.344 0.978 0 O-C-N 123.391 0.432 . . . . 0.0 112.292 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 pp -135.72 163.53 29.96 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-O 121.007 0.432 . . . . 0.0 111.896 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.83 ' SG ' ' HB3' ' A' ' 19' ' ' TYR . 48.9 t -98.5 119.01 36.47 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.625 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.444 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 0.3 OUTLIER -96.16 153.01 18.03 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.563 -178.074 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.463 HG22 ' CZ ' ' A' ' 19' ' ' TYR . 46.2 p -90.38 123.11 33.85 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.019 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.447 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 2.6 p90 -143.08 138.05 29.63 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.701 -179.364 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 1.141 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.0 t -80.21 88.43 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.524 1.13 . . . . 0.0 113.009 -178.257 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.486 ' HB3' ' HD2' ' A' ' 18' ' ' ARG . 25.0 t80 -52.27 125.38 15.74 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.962 0.505 . . . . 0.0 110.995 178.445 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.697 ' HA2' ' HB3' ' A' ' 14' ' ' ALA . . . -83.26 150.46 27.34 Favored Glycine 0 C--N 1.34 0.789 0 CA-C-N 115.871 -0.604 . . . . 0.0 113.495 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.41 23.61 23.97 Favored Glycine 0 C--N 1.339 0.716 0 O-C-N 123.785 0.344 . . . . 0.0 112.898 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.9 p -95.06 -46.93 6.6 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.526 0.33 . . . . 0.0 110.451 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -126.57 126.58 43.89 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.65 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -100.93 131.42 46.81 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -145.54 165.14 29.5 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.052 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 46.9 mmm-85 -78.3 1.63 21.14 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.823 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 58.7 t-20 -89.8 72.61 7.6 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 120.924 0.393 . . . . 0.0 110.431 179.339 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.95 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 74.4 m-80 -156.7 133.69 10.37 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.718 179.172 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.523 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 31.9 m-85 -137.78 101.77 4.55 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.991 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.731 ' HE2' ' HE ' ' A' ' 18' ' ' ARG . 51.6 mmtt -67.13 -22.85 65.77 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.9 m -113.76 133.31 55.45 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.763 0.316 . . . . 0.0 111.834 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.93 -47.59 77.15 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.915 179.108 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -48.14 -56.77 7.04 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 123.918 0.761 . . . . 0.0 110.661 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ASP . . . . . 0.705 ' HA ' ' HG2' ' A' ' 51' ' ' ARG . 57.1 m-20 -58.99 -49.66 77.04 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 122.608 0.363 . . . . 0.0 110.588 178.765 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.5 t -46.4 -49.74 17.59 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 123.934 0.771 . . . . 0.0 111.135 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 96.0 mtp -68.9 -43.55 75.02 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.705 ' HG2' ' HA ' ' A' ' 48' ' ' ASP . 33.3 ptt180 -70.21 -16.19 63.02 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.8 m -102.94 -49.56 3.75 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 123.209 0.318 . . . . 0.0 110.604 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.684 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 1.3 p -123.48 34.81 5.0 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -128.38 -99.37 0.97 Allowed Glycine 0 N--CA 1.459 0.197 0 C-N-CA 121.083 -0.58 . . . . 0.0 112.458 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.58 61.11 0.04 OUTLIER Glycine 0 C--N 1.337 0.614 0 C-N-CA 121.397 -0.43 . . . . 0.0 112.45 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.088 -179.999 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' ASP . . . . . 0.529 ' OD2' HD21 ' A' ' 4' ' ' LEU . 47.8 t0 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.553 0.216 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -128.5 -173.21 2.9 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.104 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.403 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 26.4 t 70.64 -47.9 0.65 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.705 1.202 . . . . 0.0 112.796 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.547 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 3.7 pp -81.85 -6.38 59.03 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' GLU . . . . . 0.442 ' HB3' ' HD2' ' A' ' 6' ' ' PRO . 55.2 mm-40 -87.32 163.85 37.89 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.562 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.442 ' HD2' ' HB3' ' A' ' 5' ' ' GLU . 13.7 Cg_endo -56.36 130.12 38.42 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.555 2.17 . . . . 0.0 113.223 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.566 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 21.4 Cg_endo -52.71 136.04 57.7 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 124.121 3.214 . . . . 0.0 114.408 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -130.1 117.49 20.05 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.612 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.422 HG23 ' HA ' ' A' ' 33' ' ' TYR . 41.2 m -96.28 -71.94 0.65 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.378 179.389 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.466 ' HA3' ' CB ' ' A' ' 37' ' ' ARG . . . 112.03 147.66 10.58 Favored Glycine 0 C--N 1.34 0.775 0 CA-C-O 119.146 -0.808 . . . . 0.0 111.511 -178.772 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.408 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 2.7 Cg_exo -76.4 49.12 2.54 Favored 'Trans proline' 0 C--N 1.368 1.553 0 C-N-CA 122.882 2.388 . . . . 0.0 113.055 -179.363 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' CYS . . . . . 0.69 ' HB2' ' HG2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -146.53 133.04 19.73 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.309 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.788 ' HE2' ' H ' ' A' ' 13' ' ' LYS . 0.4 OUTLIER 28.99 47.28 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 125.196 1.398 . . . . 0.0 114.549 178.796 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.652 ' HA ' ' HA2' ' A' ' 34' ' ' GLY . . . -89.52 100.25 13.09 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.913 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -155.54 30.56 0.38 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.386 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 33' ' ' TYR . 46.8 mt -143.07 128.92 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.692 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.798 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.2 mp -93.66 142.8 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.67 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 37.8 mtt180 -137.19 -176.24 4.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.678 -177.723 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.533 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.1 m-85 -116.64 148.03 41.36 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.686 0.279 . . . . 0.0 111.584 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.585 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 2.9 p90 -139.54 155.63 47.39 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.59 ' CZ ' ' HA2' ' A' ' 26' ' ' GLY . 68.4 t80 -90.38 131.97 35.86 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -99.87 130.46 46.06 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 176.962 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.39 9.93 27.06 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 123.349 0.406 . . . . 0.0 111.781 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -97.61 -24.74 15.39 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.048 179.301 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -134.97 -28.93 1.15 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.672 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.59 ' HA2' ' CZ ' ' A' ' 21' ' ' TYR . . . 95.95 8.62 57.89 Favored Glycine 0 C--N 1.342 0.914 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.297 -178.763 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 pp -95.7 151.61 19.21 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 123.834 0.373 . . . . 0.0 111.901 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 96.4 m -96.13 109.97 22.32 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.124 178.73 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.585 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 53.4 tp60 -92.15 156.94 17.0 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.031 -177.542 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.468 HG22 ' CE1' ' A' ' 19' ' ' TYR . 34.0 p -89.78 128.37 36.13 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.294 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.578 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 6.9 p90 -150.66 150.52 31.23 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.796 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.798 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.2 t -76.74 161.35 4.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 123.656 0.783 . . . . 0.0 112.395 -177.972 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.489 ' N ' ' O ' ' A' ' 16' ' ' ILE . 32.7 t80 -136.85 158.17 45.08 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.904 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.652 ' HA2' ' HA ' ' A' ' 14' ' ' ALA . . . -105.76 -164.33 23.31 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 121.146 -0.549 . . . . 0.0 113.324 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLY . . . . . 0.518 ' HA3' ' HB2' ' A' ' 13' ' ' LYS . . . -109.47 -60.83 0.52 Allowed Glycine 0 C--N 1.339 0.699 0 O-C-N 123.788 0.346 . . . . 0.0 112.716 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' CYS . . . . . 0.569 ' SG ' ' HD2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -80.05 -19.56 47.31 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 179.757 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.69 ' HG2' ' HB2' ' A' ' 12' ' ' CYS . 71.9 mmt-85 -96.85 102.95 14.82 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.053 0.454 . . . . 0.0 110.851 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -120.42 148.49 43.72 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.569 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.9 tmtp? -137.13 -124.78 0.14 Allowed 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.482 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -143.99 -1.24 0.98 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.781 0.433 . . . . 0.0 111.622 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.4 ' OD1' ' HA ' ' A' ' 3' ' ' CYS . 61.4 t-20 -109.15 78.48 1.14 Allowed 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.807 0.337 . . . . 0.0 111.737 -179.058 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.67 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 8.7 m-80 -155.63 123.89 5.85 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.81 177.472 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 36.5 m-85 -134.65 103.32 5.61 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.138 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.434 ' HG2' ' HG2' ' A' ' 18' ' ' ARG . 6.5 tmtt? -74.31 0.62 13.73 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.002 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.2 m -134.92 134.22 40.4 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.269 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.93 -45.99 86.75 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.295 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -49.11 -55.96 10.6 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.781 0.676 . . . . 0.0 110.786 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -62.53 -47.45 83.84 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 122.398 0.279 . . . . 0.0 110.763 178.768 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.506 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 53.7 t -46.68 -48.96 20.0 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 123.824 0.702 . . . . 0.0 111.37 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.5 mtt -73.69 -39.26 64.51 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 86.8 mtm180 -69.13 -19.76 64.03 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.5 m -105.72 -51.49 2.99 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 122.983 0.177 . . . . 0.0 110.841 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.506 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.2 OUTLIER -109.42 21.04 17.55 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -178.681 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.23 -62.56 0.58 Allowed Glycine 0 C--N 1.34 0.755 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.545 178.589 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.85 79.09 0.04 OUTLIER Glycine 0 C--N 1.337 0.611 0 C-N-CA 121.467 -0.396 . . . . 0.0 112.493 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.251 -0.88 . . . . 0.0 111.087 179.975 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 N--CA 1.488 1.468 0 CA-C-O 120.519 0.2 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -127.82 -164.87 1.41 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.238 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 3' ' ' CYS . . . . . 0.722 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 13.9 t 72.51 -39.66 0.45 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.808 1.243 . . . . 0.0 112.35 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.435 HD23 ' CD1' ' A' ' 21' ' ' TYR . 23.1 mt -79.51 -4.95 53.67 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -95.14 151.37 38.74 Favored Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.198 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' PRO . . . . . 0.408 ' HA ' ' HE2' ' A' ' 20' ' ' PHE . 39.2 Cg_endo -67.18 169.34 15.43 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.927 2.418 . . . . 0.0 112.908 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' PRO . . . . . 0.585 ' HD3' ' CZ ' ' A' ' 20' ' ' PHE . 36.5 Cg_endo -57.81 130.01 36.35 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 123.037 2.491 . . . . 0.0 113.101 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.959 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 9.9 t80 -95.22 -19.76 19.77 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.592 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.6 m -8.94 -80.67 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.613 0.765 . . . . 0.0 109.609 -176.876 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.39 -159.47 19.01 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.611 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -78.72 13.07 2.0 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 123.073 2.515 . . . . 0.0 113.143 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.6 m -94.85 -59.53 1.89 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.928 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt 57.51 91.23 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.095 0.958 . . . . 0.0 112.33 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . 0.504 ' CB ' ' HA2' ' A' ' 34' ' ' GLY . . . -80.98 -158.33 0.2 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.402 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.68 37.71 4.25 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.071 0.462 . . . . 0.0 111.814 -179.513 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.0 mt -129.96 91.74 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.712 -179.641 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.894 HG13 HG22 ' A' ' 32' ' ' VAL . 2.9 mp -76.39 153.87 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.079 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.599 ' N ' ' O ' ' A' ' 31' ' ' PHE . 39.2 mtt180 -154.8 -179.59 8.17 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.625 -177.952 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.749 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 2.2 m-85 -112.39 156.91 21.72 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-N 118.32 0.509 . . . . 0.0 111.731 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.585 ' CZ ' ' HD3' ' A' ' 7' ' ' PRO . 1.8 p90 -158.56 167.05 30.63 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 124.597 1.186 . . . . 0.0 108.981 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.722 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 5.5 t80 -81.71 133.8 35.39 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 118.419 0.554 . . . . 0.0 112.166 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' ASN . . . . . 0.487 ' ND2' ' CE2' ' A' ' 20' ' ' PHE . 28.5 m120 -141.27 112.88 7.61 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.104 178.471 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.92 7.28 4.99 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.0 177.969 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -96.87 -41.04 8.63 Favored 'General case' 0 C--N 1.348 0.537 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.017 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.44 -48.05 9.37 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.981 179.632 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 169.49 -62.54 0.18 Allowed Glycine 0 C--N 1.336 0.576 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.659 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.726 HD12 ' N ' ' A' ' 28' ' ' CYS . 2.3 pp -150.62 -52.49 0.14 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.368 0.267 . . . . 0.0 110.822 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' CYS . . . . . 0.726 ' N ' HD12 ' A' ' 27' ' ' LEU . 58.5 m -133.86 144.64 49.05 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.538 0.335 . . . . 0.0 110.24 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.508 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 63.3 tp60 -145.81 159.23 43.5 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.405 0.622 . . . . 0.0 112.273 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 34.9 p -77.54 142.28 39.12 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 113.946 -1.479 . . . . 0.0 112.244 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.599 ' O ' ' N ' ' A' ' 18' ' ' ARG . 6.7 p90 -152.64 147.35 26.04 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.388 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.894 HG22 HG13 ' A' ' 17' ' ' ILE . 3.2 t -99.13 110.37 26.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.241 0.617 . . . . 0.0 111.363 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.426 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 48.8 t80 -78.49 136.07 37.5 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.702 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' GLY . . . . . 0.504 ' HA2' ' CB ' ' A' ' 14' ' ' ALA . . . -92.59 155.59 22.75 Favored Glycine 0 C--N 1.338 0.664 0 O-C-N 123.561 0.538 . . . . 0.0 112.906 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -98.66 11.95 62.87 Favored Glycine 0 C--N 1.337 0.625 0 C-N-CA 121.433 -0.413 . . . . 0.0 113.346 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 17.5 p -95.14 -44.61 7.56 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.771 0.285 . . . . 0.0 110.73 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -124.76 153.49 42.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.025 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -100.6 151.02 22.1 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.276 0.56 . . . . 0.0 112.161 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.959 ' HD3' ' HB3' ' A' ' 8' ' ' TYR . 13.0 ttpp -134.07 165.18 25.66 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.356 -179.194 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 86.4 mtm180 -112.47 18.7 18.23 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.648 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.919 ' H ' ' HG2' ' A' ' 39' ' ' LYS . 64.7 t-20 -126.96 97.45 4.97 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.172 0.51 . . . . 0.0 110.936 179.751 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 3.3 m-80 -146.23 147.93 31.95 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.543 178.711 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.749 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 56.1 m-85 -160.53 81.19 0.67 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.759 0.662 . . . . 0.0 109.853 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' LYS . . . . . 0.519 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 20.2 tptm -43.25 -28.04 0.28 Allowed 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -178.158 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.4 m -136.65 154.91 50.51 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.666 0.269 . . . . 0.0 111.636 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -59.62 -50.62 73.17 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.51 179.028 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.489 ' O ' ' HB2' ' A' ' 51' ' ' ARG . 71.8 tt0 -43.63 -51.13 7.18 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.931 0.77 . . . . 0.0 110.474 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -66.07 -39.14 89.82 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.42 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.456 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 41.9 t -55.5 -59.24 5.11 Favored 'General case' 0 C--N 1.355 0.843 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.186 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 50' ' ' MET . . . . . 0.524 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 66.9 mtt -60.97 -31.96 71.52 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 122.884 0.474 . . . . 0.0 111.011 177.913 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 5.4 tmm_? -58.11 -41.94 84.65 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.57 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.433 ' HB ' ' CZ ' ' A' ' 43' ' ' PHE . 7.6 m -101.24 -51.31 3.54 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.13 12.04 37.4 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -178.529 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 54' ' ' GLY . . . . . 0.524 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . -98.87 -61.06 0.87 Allowed Glycine 0 C--N 1.341 0.841 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.581 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -111.75 -103.09 2.67 Favored Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.4 -0.429 . . . . 0.0 112.549 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.988 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.014 -179.961 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.532 0.206 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' PHE . . . . . 0.507 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 2.5 p90 -104.57 -29.76 10.44 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.926 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -83.57 -35.69 24.54 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LEU . . . . . 0.559 ' HA ' ' HB2' ' A' ' 23' ' ' ALA . 4.3 mm? -80.54 -8.18 59.49 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.547 179.083 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -112.26 155.39 43.65 Favored Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.395 179.307 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -61.52 142.83 96.3 Favored 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 122.706 2.27 . . . . 0.0 113.392 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -61.56 165.35 13.61 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 123.522 2.815 . . . . 0.0 113.395 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' TYR . . . . . 0.744 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 15.1 t80 -125.57 35.18 4.77 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.623 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 32' ' ' VAL . 7.0 m -57.92 -41.69 83.22 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.093 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' GLY . . . . . 0.637 ' HA3' ' NE ' ' A' ' 37' ' ' ARG . . . 70.91 -165.17 53.14 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.318 -0.712 . . . . 0.0 113.027 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PRO . . . . . 0.466 ' HD3' HH21 ' A' ' 37' ' ' ARG . 3.0 Cg_exo -80.83 16.75 1.54 Allowed 'Trans proline' 0 C--N 1.368 1.566 0 C-N-CA 123.052 2.501 . . . . 0.0 112.824 179.433 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.77 114.86 22.78 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.624 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -142.04 83.23 1.83 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.154 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.44 -104.44 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ARG . . . . . 0.558 ' HD3' ' N ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -137.98 34.36 2.37 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.044 0.45 . . . . 0.0 112.197 -178.428 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ILE . . . . . 0.535 ' HB ' ' O ' ' A' ' 33' ' ' TYR . 23.1 mt -127.54 61.92 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-O 121.801 0.81 . . . . 0.0 109.62 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ILE . . . . . 0.947 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.5 mp -69.82 126.7 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.57 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ARG . . . . . 0.968 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 71.2 mtt180 -127.64 -179.73 5.08 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 113.032 -1.895 . . . . 0.0 108.805 -179.548 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 19' ' ' TYR . . . . . 0.673 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.5 m-85 -111.45 153.92 25.43 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -177.835 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' PHE . . . . . 0.586 ' CE2' ' HB3' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -142.98 145.15 32.69 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 178.465 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 21' ' ' TYR . . . . . 0.482 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 44.9 t80 -101.39 119.21 38.41 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.21 93.72 5.92 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.768 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ALA . . . . . 0.559 ' HB2' ' HA ' ' A' ' 4' ' ' LEU . . . -56.9 -13.32 2.54 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.673 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 tttm -95.55 -34.65 11.95 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 118.401 0.546 . . . . 0.0 110.942 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -79.62 -31.42 41.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.914 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.6 -15.23 61.26 Favored Glycine 0 C--N 1.34 0.785 0 O-C-N 123.414 0.446 . . . . 0.0 112.999 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LEU . . . . . 0.604 HD13 ' H ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -115.55 170.64 8.27 Favored 'General case' 0 C--O 1.244 0.764 0 CA-C-O 121.141 0.496 . . . . 0.0 112.122 -179.395 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.5 t -93.55 157.64 16.09 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.154 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' GLN . . . . . 0.586 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 25.2 tt0 -144.88 130.95 19.37 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.172 -178.983 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.3 p -77.33 139.65 39.82 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PHE . . . . . 0.616 ' O ' ' N ' ' A' ' 18' ' ' ARG . 18.4 p90 -138.13 159.41 42.1 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.625 179.421 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' VAL . . . . . 0.947 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.1 t -97.89 164.52 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 123.643 0.777 . . . . 0.0 110.512 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.535 ' O ' ' HB ' ' A' ' 16' ' ' ILE . 45.3 t80 -137.49 157.21 47.04 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.693 179.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.14 -167.11 19.38 Favored Glycine 0 C--N 1.337 0.628 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.027 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.72 12.57 69.06 Favored Glycine 0 C--N 1.34 0.775 0 C-N-CA 121.609 -0.329 . . . . 0.0 113.185 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.99 -34.75 12.24 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 122.761 0.425 . . . . 0.0 112.007 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' ARG . . . . . 0.637 ' NE ' ' HA3' ' A' ' 10' ' ' GLY . 87.2 mtt-85 -132.36 150.95 52.05 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.22 0.325 . . . . 0.0 110.513 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -142.98 118.04 10.07 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.414 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.744 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 0.2 OUTLIER -148.42 174.93 11.56 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.228 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -75.97 -51.28 12.74 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.16 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASN . . . . . 0.507 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 64.7 t-20 -53.49 92.28 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.405 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ASN . . . . . 0.968 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 3.9 m-80 -157.78 109.22 2.28 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 114.559 -1.201 . . . . 0.0 108.914 177.697 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PHE . . . . . 0.673 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 0.7 OUTLIER -97.42 -168.53 1.7 Allowed 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -176.655 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.93 -68.58 0.82 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 113.242 -1.799 . . . . 0.0 112.609 178.332 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.45 ' HA ' ' CE2' ' A' ' 19' ' ' TYR . 52.6 m -154.43 177.35 11.26 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.268 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.32 -37.32 72.32 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.48 -54.46 46.35 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 123.356 0.41 . . . . 0.0 111.187 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -73.23 -31.73 64.32 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.603 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' CYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 45' ' ' SER . 7.6 t -58.94 -40.8 85.76 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.374 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 74.0 mtm -84.03 -34.21 24.33 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 123.627 0.579 . . . . 0.0 110.533 178.183 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -54.6 -38.14 66.42 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.705 178.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' THR . . . . . 0.439 ' HB ' ' HZ ' ' A' ' 43' ' ' PHE . 11.5 m -100.37 -48.04 4.71 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.57 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' CYS . . . . . 0.482 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -116.1 55.16 0.81 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -179.145 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -103.19 -55.75 0.8 Allowed Glycine 0 C--N 1.335 0.475 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.48 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 140.78 57.3 0.04 OUTLIER Glycine 0 C--N 1.336 0.581 0 C-N-CA 121.415 -0.421 . . . . 0.0 112.453 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.088 -179.963 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 120.55 0.214 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.48 ' HB2' ' HA ' ' A' ' 41' ' ' ASN . 0.4 OUTLIER -129.7 52.03 2.03 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.376 0.608 . . . . 0.0 111.314 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.0 t -128.93 -51.07 1.22 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.733 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -100.58 8.44 43.44 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 123.47 0.481 . . . . 0.0 112.135 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.47 ' HB2' ' OD1' ' A' ' 41' ' ' ASN . 55.3 mm-40 -89.87 141.2 28.01 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.121 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 4.2 Cg_exo -75.7 159.37 38.88 Favored 'Trans proline' 0 C--N 1.369 1.613 0 C-N-CA 123.107 2.538 . . . . 0.0 113.085 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.587 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 58.7 Cg_endo -63.1 148.12 93.62 Favored 'Trans proline' 0 C--N 1.37 1.709 0 C-N-CA 123.518 2.812 . . . . 0.0 113.619 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -107.8 45.9 0.98 Allowed 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.39 0.614 . . . . 0.0 110.83 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.639 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 21.8 m -54.17 -48.25 71.11 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.755 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 54.66 -150.89 16.19 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-O 119.291 -0.727 . . . . 0.0 113.22 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -87.84 15.74 2.06 Favored 'Trans proline' 0 C--N 1.366 1.45 0 C-N-CA 122.968 2.446 . . . . 0.0 113.344 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -140.87 120.17 13.03 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.422 0.289 . . . . 0.0 111.541 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.752 ' HE2' ' HA ' ' A' ' 33' ' ' TYR . 2.1 tptm -179.16 108.28 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.969 1.308 . . . . 0.0 108.114 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.579 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -76.66 -141.82 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.881 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.45 ' CZ ' ' HB1' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -104.45 46.1 0.93 Allowed 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.168 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.0 mt -129.0 90.59 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 1.058 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.2 mp -76.5 144.67 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-O 121.73 0.776 . . . . 0.0 110.58 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.751 ' HG2' ' HA ' ' A' ' 44' ' ' LYS . 4.8 ttt180 -134.2 -160.32 1.04 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 113.633 -1.621 . . . . 0.0 110.237 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -132.78 147.24 52.31 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.659 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 6.2 p90 -144.97 141.94 29.39 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.57 ' CE2' ' HG2' ' A' ' 50' ' ' MET . 17.3 t80 -84.47 120.7 26.61 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.515 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 0.7 OUTLIER -97.0 95.85 8.09 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.362 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.88 -14.17 0.19 Allowed 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -178.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -95.91 -26.66 15.51 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 117.536 0.153 . . . . 0.0 111.214 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB3' ' HB2' ' A' ' 22' ' ' ASN . . . -85.1 -44.84 12.64 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.515 0.509 . . . . 0.0 111.689 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.69 -8.34 25.95 Favored Glycine 0 C--N 1.343 0.923 0 C-N-CA 121.25 -0.5 . . . . 0.0 113.495 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.515 ' N ' HD13 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -141.56 175.31 9.78 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.947 0.374 . . . . 0.0 111.708 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 94.4 m -94.42 102.89 14.87 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.635 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.5 tp60 -79.76 148.36 31.5 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.644 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 40.7 p -78.41 121.95 25.18 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.691 ' O ' ' N ' ' A' ' 18' ' ' ARG . 5.5 p90 -138.83 154.03 48.41 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 114.195 -1.366 . . . . 0.0 108.253 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 1.058 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 14.3 t -76.94 163.7 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 CA-C-N 118.508 0.595 . . . . 0.0 112.407 -178.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.752 ' HA ' ' HE2' ' A' ' 13' ' ' LYS . 55.3 t80 -117.5 146.54 43.47 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.099 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -119.12 151.16 17.72 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 120.996 -0.621 . . . . 0.0 113.213 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.16 -15.01 46.36 Favored Glycine 0 C--N 1.339 0.702 0 O-C-N 123.86 0.388 . . . . 0.0 112.733 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.94 -34.85 17.97 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 122.704 0.402 . . . . 0.0 111.693 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -97.34 -72.06 0.66 Allowed 'General case' 0 CA--C 1.536 0.411 0 O-C-N 123.233 0.333 . . . . 0.0 110.443 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 47.55 117.95 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.581 1.152 . . . . 0.0 113.888 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -131.74 -173.17 3.06 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.26 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -75.53 -47.81 25.26 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.448 -177.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.599 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.2 OUTLIER -69.98 76.57 0.48 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.217 0.532 . . . . 0.0 111.627 -179.523 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -154.74 128.51 8.69 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.095 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.54 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 56.9 m-85 -129.97 135.21 48.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.137 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.751 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 3.2 tppp? -80.1 -38.89 30.73 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 123.267 0.354 . . . . 0.0 111.872 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.8 m -111.87 138.53 48.35 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 123.234 0.334 . . . . 0.0 111.661 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.63 -31.62 72.85 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.709 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.4 mp0 -63.56 -56.9 12.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.347 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -68.75 -24.13 64.41 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.156 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.54 ' HA ' ' CD2' ' A' ' 43' ' ' PHE . 43.4 t -66.81 -54.86 18.2 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.659 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.57 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 96.7 mtp -73.26 -30.36 63.39 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.091 0.557 . . . . 0.0 112.218 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -74.0 -37.68 64.34 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 123.282 0.364 . . . . 0.0 111.693 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.4 m -85.91 -33.81 21.11 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 123.129 0.268 . . . . 0.0 111.436 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.496 ' HB3' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -87.02 -50.11 6.87 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 121.24 -0.184 . . . . 0.0 110.565 179.928 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.856 0 O-C-N 123.443 0.464 . . . . 0.0 112.547 -179.91 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.549 0.214 . . . . 0.0 111.119 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -104.85 -161.13 0.8 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.049 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 42.2 t 73.82 -47.26 0.65 Allowed 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.443 1.097 . . . . 0.0 111.826 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -98.78 -12.86 20.5 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 123.188 0.305 . . . . 0.0 111.571 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 5.8 mm-40 -97.85 147.9 33.71 Favored Pre-proline 0 CA--C 1.537 0.446 0 O-C-N 123.258 0.349 . . . . 0.0 111.04 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 3.7 Cg_exo -78.04 165.13 26.54 Favored 'Trans proline' 0 C--N 1.369 1.631 0 C-N-CA 123.264 2.643 . . . . 0.0 112.949 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.565 ' HD3' ' CD1' ' A' ' 20' ' ' PHE . 50.0 Cg_endo -60.48 161.1 21.58 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 123.492 2.795 . . . . 0.0 113.085 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.447 ' CE2' ' HD2' ' A' ' 37' ' ' ARG . 10.3 t80 -125.83 36.27 4.56 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.45 ' OG1' ' HD2' ' A' ' 31' ' ' PHE . 11.8 m -62.04 -47.79 83.16 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 178.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.37 -161.03 53.51 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.704 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.46 42.1 1.19 Allowed 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 123.067 2.511 . . . . 0.0 112.572 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.4 m -92.35 -66.12 0.95 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.466 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? 66.03 98.18 0.05 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.016 0.927 . . . . 0.0 111.571 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.544 ' HB1' HH21 ' A' ' 15' ' ' ARG . . . -119.03 -175.05 2.83 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.535 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.895 ' HE ' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -109.0 38.24 2.34 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.163 0.506 . . . . 0.0 111.866 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.419 ' C ' HG13 ' A' ' 32' ' ' VAL . 16.2 mt -138.52 71.41 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.384 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 1.062 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 13.1 tt -75.06 117.32 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-O 122.403 1.097 . . . . 0.0 111.48 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.761 ' N ' ' O ' ' A' ' 31' ' ' PHE . 54.4 mtt180 -100.28 -159.22 0.72 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 112.668 -2.06 . . . . 0.0 109.818 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.452 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 10.2 m-85 -125.5 164.23 20.95 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.736 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 7.1 p90 -158.13 164.31 36.74 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.894 -1.048 . . . . 0.0 108.994 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.632 ' HD1' ' SG ' ' A' ' 28' ' ' CYS . 63.1 t80 -108.9 110.28 21.56 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.641 HD21 ' HB2' ' A' ' 29' ' ' GLN . 0.2 OUTLIER -77.53 83.48 3.93 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.489 0.661 . . . . 0.0 109.916 -179.418 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 3' ' ' CYS . . . -62.31 -2.62 1.05 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.213 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -96.95 -38.07 9.95 Favored 'General case' 0 C--N 1.346 0.452 0 C-N-CA 122.359 0.263 . . . . 0.0 110.763 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -87.04 -56.01 3.57 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.016 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 153.56 -55.81 0.43 Allowed Glycine 0 C--N 1.343 0.929 0 C-N-CA 121.295 -0.478 . . . . 0.0 112.453 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 pp -96.74 -175.16 3.21 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -178.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.632 ' SG ' ' HD1' ' A' ' 21' ' ' TYR . 89.1 m -98.67 139.62 34.1 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.271 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.641 ' HB2' HD21 ' A' ' 22' ' ' ASN . 0.1 OUTLIER -123.38 153.64 40.09 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 123.263 0.352 . . . . 0.0 110.625 -179.713 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.674 ' HB ' HG12 ' A' ' 17' ' ' ILE . 40.4 p -85.36 120.0 26.35 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.761 ' O ' ' N ' ' A' ' 18' ' ' ARG . 4.1 p90 -108.77 163.3 13.39 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 114.263 -1.335 . . . . 0.0 107.421 177.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 1.062 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 41.0 t -104.39 144.25 14.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 119.546 1.066 . . . . 0.0 109.71 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.578 ' HB2' ' HD2' ' A' ' 18' ' ' ARG . 39.0 t80 -115.07 124.66 52.15 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.007 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -125.45 -168.29 12.69 Favored Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.581 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -97.28 23.9 33.79 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 121.353 -0.451 . . . . 0.0 112.936 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 21.6 p -95.5 -44.05 7.69 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.281 0.233 . . . . 0.0 111.055 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.447 ' HD2' ' CE2' ' A' ' 8' ' ' TYR . 40.2 mmt180 -133.4 169.68 16.59 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.897 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -158.66 120.96 3.6 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.031 0.532 . . . . 0.0 110.084 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -141.65 -169.1 2.82 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.326 0.584 . . . . 0.0 112.082 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -76.23 -67.61 0.67 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.93 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.449 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.4 OUTLIER -44.9 99.6 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -178.448 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.52 ' ND2' HH11 ' A' ' 18' ' ' ARG . 7.5 m120 -151.37 139.28 19.95 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.947 178.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.736 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 97.7 m-85 -142.71 147.71 36.09 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.588 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -96.71 -44.04 7.28 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.643 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.4 m -133.9 165.07 25.85 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.432 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -62.36 -69.58 0.25 Allowed 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.052 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 67.7 tt0 -51.52 -37.01 47.27 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.813 0.445 . . . . 0.0 111.283 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.409 ' HA ' ' HG2' ' A' ' 51' ' ' ARG . 1.4 m-20 -69.0 -34.0 74.56 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.462 178.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.662 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 33.8 t -65.93 -46.19 79.15 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.005 178.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.448 ' SD ' ' SG ' ' A' ' 28' ' ' CYS . 1.4 mpt? -64.75 -52.29 57.77 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.931 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 46.0 ptt85 -64.34 -37.16 86.53 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -178.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 25.5 m -80.38 -31.52 37.76 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.588 ' SG ' ' CD2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -88.41 -63.18 1.34 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 119.454 -0.307 . . . . 0.0 111.502 -179.616 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.455 ' N ' ' SG ' ' A' ' 53' ' ' CYS . . . . . . . . 0 C--N 1.347 1.148 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.553 -179.99 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.476 0.179 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -96.14 7.74 45.62 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.028 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.535 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 46.9 t -84.05 -24.0 30.61 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.008 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.493 ' HA ' ' CB ' ' A' ' 23' ' ' ALA . 4.1 mm? -116.86 -12.53 10.75 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.651 0.594 . . . . 0.0 111.471 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.412 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 5.8 mm-40 -96.52 144.37 27.73 Favored Pre-proline 0 N--CA 1.468 0.43 0 O-C-N 123.287 0.367 . . . . 0.0 111.154 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 4.9 Cg_exo -78.7 163.18 26.67 Favored 'Trans proline' 0 C--N 1.369 1.642 0 C-N-CA 123.293 2.662 . . . . 0.0 113.052 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.513 ' HD3' ' CE1' ' A' ' 20' ' ' PHE . 62.6 Cg_endo -64.25 168.84 11.83 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 123.498 2.798 . . . . 0.0 113.084 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.537 ' CZ ' ' HD3' ' A' ' 37' ' ' ARG . 7.2 t80 -129.27 1.16 5.15 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.3 m -44.22 -13.05 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 49.46 -146.21 7.27 Favored Glycine 0 CA--C 1.535 1.327 0 N-CA-C 114.657 0.623 . . . . 0.0 114.657 177.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -83.43 4.72 6.84 Favored 'Trans proline' 0 C--N 1.37 1.698 0 C-N-CA 123.405 2.737 . . . . 0.0 113.487 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.4 136.61 33.79 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.1 82.74 2.04 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.867 -1.06 . . . . 0.0 109.798 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.6 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -78.57 -161.16 0.26 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.367 -1.288 . . . . 0.0 111.094 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.759 ' HE ' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -120.84 39.37 3.8 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.188 0.518 . . . . 0.0 111.358 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.551 ' HB ' ' O ' ' A' ' 33' ' ' TYR . 24.5 mt -134.97 75.66 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.061 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 1.08 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 21.2 mm -55.83 144.78 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 123.692 0.797 . . . . 0.0 110.837 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.53 HH12 ' HE3' ' A' ' 44' ' ' LYS . 14.4 mmt180 -149.11 171.63 16.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 113.679 -1.601 . . . . 0.0 110.166 -177.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.469 ' C ' ' HB2' ' A' ' 43' ' ' PHE . 4.3 m-85 -117.63 155.76 29.32 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 121.261 -0.176 . . . . 0.0 111.237 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.805 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 1.0 OUTLIER -146.68 152.86 39.55 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 123.643 0.589 . . . . 0.0 110.112 178.797 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.509 ' HB2' ' SG ' ' A' ' 49' ' ' CYS . 30.3 t80 -100.43 132.94 45.54 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.586 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -95.31 127.11 41.09 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.128 -0.694 . . . . 0.0 109.128 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 3' ' ' CYS . . . -94.59 14.15 21.87 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.603 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -97.03 -23.1 16.43 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.463 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -136.77 -23.25 1.2 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.264 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 97.69 -7.79 63.45 Favored Glycine 0 C--N 1.346 1.106 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.106 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.463 ' HG ' ' HB3' ' A' ' 25' ' ' ALA . 3.4 pp -87.31 144.8 26.62 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 122.757 0.423 . . . . 0.0 111.759 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.479 ' H ' ' HE1' ' A' ' 50' ' ' MET . 78.3 m -92.19 142.3 27.64 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.832 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.538 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 2.5 tm0? -124.22 145.58 49.26 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.185 0.516 . . . . 0.0 111.835 -178.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.413 HG22 ' CZ ' ' A' ' 19' ' ' TYR . 39.8 p -85.4 143.11 28.81 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.509 -1.223 . . . . 0.0 111.826 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.559 ' CZ ' ' HB3' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -165.13 176.13 8.76 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.9 178.343 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 1.08 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 1.3 t -92.77 -162.07 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 124.32 1.048 . . . . 0.0 111.141 -178.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.749 ' H ' HG12 ' A' ' 32' ' ' VAL . 65.4 t80 -174.33 144.15 0.91 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.631 1.173 . . . . 0.0 109.037 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.89 -160.55 9.59 Favored Glycine 0 C--N 1.337 0.602 0 C-N-CA 120.962 -0.637 . . . . 0.0 113.225 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -94.77 15.05 64.18 Favored Glycine 0 C--N 1.338 0.693 0 O-C-N 123.781 0.342 . . . . 0.0 113.406 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -48.03 7.47 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.537 ' HD3' ' CZ ' ' A' ' 8' ' ' TYR . 2.6 mmp_? -135.49 119.54 17.55 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.021 0.439 . . . . 0.0 111.498 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -118.46 119.38 34.4 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.635 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.405 ' HB3' ' H ' ' A' ' 40' ' ' ARG . 9.8 tmtt? -124.43 -114.87 0.29 Allowed 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.824 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.405 ' H ' ' HB3' ' A' ' 39' ' ' LYS . 24.4 mmm180 -142.39 -33.37 0.48 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 122.657 0.383 . . . . 0.0 111.306 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.492 ' ND2' ' HB2' ' A' ' 20' ' ' PHE . 0.4 OUTLIER -66.62 101.38 0.78 Allowed 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.696 0.76 . . . . 0.0 111.45 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -146.38 150.57 35.93 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 114.343 -1.299 . . . . 0.0 109.61 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.805 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 64.6 m-85 -153.36 165.35 36.05 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.811 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.53 ' HE3' HH12 ' A' ' 18' ' ' ARG . 13.8 mptt -99.02 -54.82 2.88 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.701 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.6 m -143.71 170.6 15.56 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.724 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.87 -46.79 87.9 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -52.17 -60.57 3.05 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.069 0.548 . . . . 0.0 110.941 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 52' ' ' THR . 49.0 m-20 -59.55 -53.44 58.11 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.316 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.632 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 28.5 t -40.28 -48.25 2.6 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.546 0.738 . . . . 0.0 111.961 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.479 ' HE1' ' H ' ' A' ' 28' ' ' CYS . 25.6 mmt -67.59 -47.11 70.68 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.854 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -79.3 -9.55 59.61 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 48' ' ' ASP . 40.2 m -91.67 -45.38 8.49 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.264 0.225 . . . . 0.0 110.586 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.64 -43.72 8.16 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 123.159 0.287 . . . . 0.0 110.802 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.043 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.716 179.968 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 120.55 0.214 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -124.91 -167.22 1.64 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.17 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 21' ' ' TYR . 6.6 t 72.1 -36.24 0.35 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.728 1.211 . . . . 0.0 112.552 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.496 ' CD1' ' HB2' ' A' ' 23' ' ' ALA . 13.7 tp -80.05 -10.4 59.77 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 123.419 0.45 . . . . 0.0 111.844 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -95.75 152.59 39.18 Favored Pre-proline 0 CA--C 1.536 0.435 0 O-C-N 123.395 0.435 . . . . 0.0 110.374 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.92 149.46 90.13 Favored 'Trans proline' 0 C--N 1.368 1.602 0 C-N-CA 122.603 2.202 . . . . 0.0 113.166 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.466 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 31.1 Cg_endo -55.71 138.21 80.57 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 123.648 2.899 . . . . 0.0 113.476 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.571 ' O ' ' N ' ' A' ' 10' ' ' GLY . 1.6 t80 -91.18 8.11 37.36 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.568 0.543 . . . . 0.0 111.861 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 32' ' ' VAL . 10.6 m -30.04 -18.99 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 -178.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.571 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 5.86 110.91 0.0 OUTLIER Glycine 0 C--N 1.358 1.762 0 CA-C-O 118.41 -1.217 . . . . 0.0 114.488 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -23.06 87.1 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 124.953 3.769 . . . . 0.0 115.559 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.9 m -129.9 -157.49 0.82 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.283 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -98.6 71.61 1.98 Allowed 'General case' 0 C--O 1.239 0.543 0 CA-C-O 122.209 1.004 . . . . 0.0 108.318 178.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.664 ' HB1' HG12 ' A' ' 32' ' ' VAL . . . -100.16 128.02 46.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 113.688 -1.596 . . . . 0.0 111.82 -179.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.74 20.78 2.34 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.832 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.2 mt -137.21 105.1 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.877 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.909 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 9.1 tt -81.44 134.72 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 121.545 0.688 . . . . 0.0 110.26 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.814 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 57.7 mtt180 -128.44 -176.92 3.97 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.864 -1.516 . . . . 0.0 111.105 -177.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.551 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.8 m-85 -122.83 148.55 45.26 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.466 ' CE2' ' HD3' ' A' ' 7' ' ' PRO . 8.9 p90 -144.3 150.6 38.12 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.357 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.652 ' HE1' ' HA2' ' A' ' 26' ' ' GLY . 3.7 t80 -86.56 125.3 33.69 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -97.4 121.94 39.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.496 ' HB2' ' CD1' ' A' ' 4' ' ' LEU . . . -80.36 5.26 15.39 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -96.55 -16.57 21.0 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.873 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.09 -39.36 1.74 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.106 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.652 ' HA2' ' HE1' ' A' ' 21' ' ' TYR . . . 114.12 -42.4 1.94 Allowed Glycine 0 C--N 1.343 0.934 0 C-N-CA 121.416 -0.421 . . . . 0.0 112.317 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.737 HD23 ' H ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -77.1 169.6 18.04 Favored 'General case' 0 C--O 1.243 0.754 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -179.127 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 62.7 m -96.05 136.14 36.9 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.167 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.551 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 38.1 mt-30 -106.15 156.17 18.71 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 123.746 0.654 . . . . 0.0 111.652 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.523 HG22 ' CE1' ' A' ' 19' ' ' TYR . 47.8 p -92.26 129.44 38.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.398 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.474 ' C ' HG13 ' A' ' 17' ' ' ILE . 3.1 p90 -142.83 138.76 30.56 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.423 -0.808 . . . . 0.0 108.968 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.909 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 26.0 t -88.7 103.79 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 122.889 0.475 . . . . 0.0 111.74 -178.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -68.08 146.19 53.71 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.367 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -120.31 153.24 16.76 Favored Glycine 0 C--N 1.336 0.556 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.01 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -98.79 44.64 1.7 Allowed Glycine 0 C--N 1.336 0.575 0 C-N-CA 121.254 -0.498 . . . . 0.0 113.103 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.5 p -95.7 -36.18 11.29 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.434 ' O ' ' HB3' ' A' ' 38' ' ' ALA . 88.4 mtt-85 -128.17 -67.57 0.8 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 123.311 0.382 . . . . 0.0 111.394 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 37' ' ' ARG . . . 96.36 132.91 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.093 1.357 . . . . 0.0 110.056 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -129.16 -112.17 0.27 Allowed 'General case' 0 CA--C 1.548 0.897 0 O-C-N 123.563 0.539 . . . . 0.0 111.772 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -151.67 -35.42 0.13 Allowed 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.497 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.3 OUTLIER -76.96 94.71 4.0 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.087 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.814 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 9.7 m120 -157.86 125.01 5.05 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.501 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.546 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 82.1 m-85 -132.51 101.54 5.36 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -65.51 -13.29 58.57 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.3 m -131.07 140.3 50.02 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.638 0.256 . . . . 0.0 111.271 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.74 -48.0 76.2 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.13 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -47.72 -59.16 3.5 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 124.008 0.818 . . . . 0.0 110.281 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -63.68 -36.74 84.86 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.625 0.37 . . . . 0.0 111.18 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.705 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 51.0 t -56.41 -60.48 3.46 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 123.594 0.558 . . . . 0.0 110.758 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.0 mtt -63.56 -36.89 85.3 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.5 ttt85 -67.39 -38.46 84.74 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 16.9 m -79.07 -49.72 12.21 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 122.879 0.112 . . . . 0.0 111.084 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.705 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -80.92 -58.59 3.02 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.107 0 C-N-CA 120.906 -0.664 . . . . 0.0 113.23 -179.598 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.503 0.192 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -123.64 -148.44 0.4 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.197 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.494 ' SG ' ' HB3' ' A' ' 21' ' ' TYR . 34.0 t 70.45 -14.06 0.43 Allowed 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 124.299 1.039 . . . . 0.0 112.638 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.499 HD13 ' CE2' ' A' ' 21' ' ' TYR . 19.1 tp -92.93 42.7 1.11 Allowed 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.533 0.682 . . . . 0.0 111.088 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.45 ' HB3' ' NZ ' ' A' ' 39' ' ' LYS . 61.1 mp0 -129.98 144.92 55.03 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.966 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -71.45 153.88 60.68 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 122.887 2.391 . . . . 0.0 112.804 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.442 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 36.4 Cg_endo -57.83 133.7 57.82 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 123.458 2.772 . . . . 0.0 113.265 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -105.17 13.27 30.92 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.01 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 12' ' ' CYS . 7.1 m -46.01 -24.15 0.39 Allowed 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.412 0.685 . . . . 0.0 112.702 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 53.47 -141.53 30.98 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-O 119.482 -0.621 . . . . 0.0 114.351 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.489 ' HD2' ' HE ' ' A' ' 37' ' ' ARG . 6.3 Cg_exo -79.25 -4.48 13.79 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 123.296 2.664 . . . . 0.0 113.218 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.522 ' O ' HG22 ' A' ' 9' ' ' THR . 0.1 OUTLIER -86.01 141.27 29.61 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 179.712 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.01 85.93 2.21 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.647 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.433 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -78.01 -167.51 1.03 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 114.569 -1.196 . . . . 0.0 111.498 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.755 ' HD3' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -119.43 34.34 5.26 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 121.178 0.513 . . . . 0.0 111.45 -179.073 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.3 mt -132.29 78.36 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.44 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 1.045 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.0 mp -65.28 145.9 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-O 121.454 0.645 . . . . 0.0 109.669 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.711 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 65.4 mtt180 -148.19 168.81 21.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.726 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.534 ' CE1' HG22 ' A' ' 30' ' ' THR . 1.6 m-85 -112.85 148.4 34.98 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.596 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 4.8 p90 -141.49 152.77 44.47 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.449 1.093 . . . . 0.0 109.435 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.551 ' HE1' ' HA2' ' A' ' 26' ' ' GLY . 7.5 t80 -83.68 144.45 29.38 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -123.07 122.38 38.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.474 ' HB2' HD11 ' A' ' 4' ' ' LEU . . . -79.75 10.57 3.94 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.686 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -96.56 -22.25 17.18 Favored 'General case' 0 C--N 1.346 0.444 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.52 ' O ' HD23 ' A' ' 27' ' ' LEU . . . -133.0 -11.6 2.93 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.075 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.551 ' HA2' ' HE1' ' A' ' 21' ' ' TYR . . . 86.8 -39.63 3.09 Favored Glycine 0 C--N 1.345 1.047 0 C-N-CA 121.555 -0.355 . . . . 0.0 113.291 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.604 HD23 ' H ' ' A' ' 27' ' ' LEU . 0.4 OUTLIER -76.51 178.25 6.78 Favored 'General case' 0 C--O 1.244 0.8 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.3 m -102.27 151.01 22.73 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.985 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.596 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 53.7 tp60 -116.45 158.62 23.26 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.716 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.534 HG22 ' CE1' ' A' ' 19' ' ' TYR . 39.9 p -94.0 126.49 39.25 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.791 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.593 ' O ' ' N ' ' A' ' 18' ' ' ARG . 2.7 p90 -145.18 140.29 27.82 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.055 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 1.045 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -89.08 101.26 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 C-N-CA 123.45 0.7 . . . . 0.0 112.526 -178.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -73.71 148.54 42.57 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.234 178.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -140.78 -172.97 13.23 Favored Glycine 0 C--N 1.338 0.641 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.34 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -94.5 1.58 66.68 Favored Glycine 0 C--N 1.34 0.767 0 O-C-N 123.767 0.334 . . . . 0.0 113.266 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -37.71 19.28 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.489 ' HE ' ' HD2' ' A' ' 11' ' ' PRO . 88.6 mtt-85 -137.05 111.85 8.82 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.936 0.398 . . . . 0.0 111.101 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -93.85 144.01 25.82 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.918 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.45 ' NZ ' ' HB3' ' A' ' 5' ' ' GLU . 4.6 tmtp? -134.78 -128.04 0.16 Allowed 'General case' 0 CA--C 1.55 0.946 0 O-C-N 123.464 0.477 . . . . 0.0 110.744 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 78.2 mtm180 -144.28 -32.38 0.43 Allowed 'General case' 0 C--N 1.351 0.667 0 CA-C-N 118.185 0.448 . . . . 0.0 112.146 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -89.43 102.02 14.7 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.416 0.627 . . . . 0.0 111.363 -179.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.711 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 69.7 m-80 -144.64 116.92 8.46 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.862 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.431 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 70.3 m-85 -138.79 108.06 6.1 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.528 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -62.97 -16.81 60.9 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 60.0 p -130.98 136.68 48.76 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 120.731 0.3 . . . . 0.0 111.28 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.437 ' HB2' ' CE2' ' A' ' 19' ' ' TYR . . . -60.83 -43.12 98.69 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.444 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -48.6 -61.75 1.86 Allowed 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.857 0.723 . . . . 0.0 110.908 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -61.8 -38.24 87.38 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 122.433 0.293 . . . . 0.0 111.176 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.489 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 47.0 t -54.49 -60.04 3.88 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 123.653 0.596 . . . . 0.0 110.754 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 68.4 mtt -60.98 -40.5 93.69 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.061 0.545 . . . . 0.0 112.103 179.397 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -65.23 -30.72 71.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.407 HG21 ' HZ ' ' A' ' 43' ' ' PHE . 21.3 m -82.46 -50.3 9.01 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 122.921 0.138 . . . . 0.0 110.848 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -86.98 -58.98 2.39 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.869 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.464 -179.761 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 45.4 p30 . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 120.493 0.187 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -124.33 175.01 7.35 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.402 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.574 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 11.7 t 70.5 -15.67 0.35 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 124.48 1.112 . . . . 0.0 113.193 179.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.5 -14.25 59.0 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -100.41 155.66 36.12 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.198 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.21 165.28 5.61 Favored 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 122.809 2.339 . . . . 0.0 112.827 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.571 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 28.9 Cg_endo -55.3 134.17 62.29 Favored 'Trans proline' 0 C--N 1.376 1.98 0 C-N-CA 123.318 2.679 . . . . 0.0 113.172 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.563 ' HD2' ' HB3' ' A' ' 39' ' ' LYS . 3.6 t80 -87.1 22.02 2.18 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 123.505 0.503 . . . . 0.0 112.057 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.645 HG23 HG12 ' A' ' 32' ' ' VAL . 20.2 m -50.17 -31.38 13.48 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.076 0.55 . . . . 0.0 111.287 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 37.87 -133.29 1.25 Allowed Glycine 0 C--N 1.352 1.454 0 O-C-N 124.126 0.891 . . . . 0.0 114.026 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -83.32 3.93 7.41 Favored 'Trans proline' 0 C--N 1.366 1.486 0 C-N-CA 123.062 2.508 . . . . 0.0 112.51 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.7 m -97.27 140.96 30.97 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.16 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -148.58 85.87 1.51 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.261 0.553 . . . . 0.0 110.444 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.421 ' O ' HG21 ' A' ' 32' ' ' VAL . . . -91.36 -171.4 2.93 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.999 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.19 35.82 3.13 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.158 0.504 . . . . 0.0 112.035 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 17.4 mt -135.11 95.01 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.566 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 1.042 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.9 mp -93.87 138.86 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 121.74 0.781 . . . . 0.0 110.017 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.796 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 31.6 mtt180 -127.38 -153.19 0.55 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 113.497 -1.683 . . . . 0.0 109.546 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 3.4 m-85 -116.4 170.7 8.35 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.509 0.595 . . . . 0.0 112.262 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.646 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 9.3 p90 -159.52 167.76 27.82 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.571 1.169 . . . . 0.0 110.362 176.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.612 ' CD2' ' HB2' ' A' ' 53' ' ' CYS . 5.2 t80 -106.65 102.05 11.46 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.43 86.48 3.81 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.717 0.77 . . . . 0.0 109.095 178.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.432 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . . . -71.12 0.73 7.03 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.605 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.8 ttpt -95.02 -34.15 12.45 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.32 -49.01 6.16 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.17 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 145.38 -57.76 0.52 Allowed Glycine 0 C--N 1.343 0.963 0 O-C-N 123.452 0.47 . . . . 0.0 112.853 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 pp -89.88 -175.4 4.59 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.3 m -99.59 136.76 39.05 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.666 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.646 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 20.9 tt0 -111.05 -151.29 0.48 Allowed 'General case' 0 C--O 1.243 0.744 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 19' ' ' TYR . 34.1 p -138.69 135.35 34.72 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-N 118.789 0.722 . . . . 0.0 111.468 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.719 ' O ' ' N ' ' A' ' 18' ' ' ARG . 1.3 p90 -133.87 165.55 24.73 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.777 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 1.042 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.2 p -78.16 -163.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 C-N-CA 123.398 0.679 . . . . 0.0 111.533 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.724 ' H ' HG22 ' A' ' 32' ' ' VAL . 64.7 t80 -169.31 113.37 0.53 Allowed 'General case' 0 C--O 1.238 0.45 0 C-N-CA 124.145 0.978 . . . . 0.0 108.983 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -117.87 160.65 13.66 Favored Glycine 0 C--N 1.334 0.424 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.585 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -88.25 44.75 3.22 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 121.487 -0.387 . . . . 0.0 112.368 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.5 p -95.27 -49.15 5.6 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.478 0.311 . . . . 0.0 111.207 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -130.99 -37.34 1.29 Allowed 'General case' 0 N--CA 1.467 0.42 0 O-C-N 123.288 0.368 . . . . 0.0 111.485 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 53.86 113.65 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.123 0.969 . . . . 0.0 112.861 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.563 ' HB3' ' HD2' ' A' ' 8' ' ' TYR . 5.0 pttt -124.75 166.13 16.73 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.804 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -83.34 57.45 4.0 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.493 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.3 OUTLIER -148.58 92.82 2.05 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.664 178.632 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.796 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 9.1 m120 -156.9 143.97 18.69 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.2 178.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.483 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 31.3 m-85 -136.65 147.21 46.74 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -96.76 -43.38 7.55 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.576 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.6 m -127.46 158.63 36.86 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.44 -59.6 3.83 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.778 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -48.62 -39.96 25.93 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.317 0.647 . . . . 0.0 111.64 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -74.43 -34.87 63.34 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.997 178.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.483 ' HA ' ' CD2' ' A' ' 43' ' ' PHE . 45.2 t -67.75 -23.74 65.27 Favored 'General case' 0 C--N 1.349 0.556 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.692 177.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.621 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 94.3 mtp -83.71 -51.86 6.9 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -49.18 -38.47 25.95 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.057 179.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.2 m -92.5 -49.78 5.95 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.187 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.612 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 1.6 p -128.34 65.25 1.4 Allowed 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.621 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.337 0.614 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.438 179.551 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.583 0.23 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -119.65 175.5 5.83 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.361 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.594 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 22.9 t 71.6 -37.31 0.39 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.647 1.179 . . . . 0.0 112.955 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 mp -82.71 -10.61 58.83 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -90.72 157.04 44.46 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.659 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -57.8 143.19 96.01 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.79 2.327 . . . . 0.0 113.181 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.54 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 39.8 Cg_endo -59.14 128.6 28.26 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 123.468 2.779 . . . . 0.0 113.824 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.653 ' HE2' ' HD3' ' A' ' 37' ' ' ARG . 81.4 t80 -129.6 100.93 5.7 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.738 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.483 HG23 ' N ' ' A' ' 34' ' ' GLY . 90.3 m -96.6 -79.65 0.45 Allowed 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.414 ' HA2' ' HD3' ' A' ' 11' ' ' PRO . . . 128.57 131.79 3.46 Favored Glycine 0 C--N 1.338 0.652 0 CA-C-O 118.83 -0.983 . . . . 0.0 110.666 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.414 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 15.1 Cg_exo -68.89 72.3 1.05 Allowed 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.704 2.27 . . . . 0.0 112.608 -179.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 51.2 m -126.02 -107.66 0.32 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.042 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -132.0 73.25 1.52 Allowed 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.444 0.64 . . . . 0.0 109.986 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.525 ' HB1' HG12 ' A' ' 32' ' ' VAL . . . -97.75 116.59 30.27 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.638 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -139.3 33.31 2.09 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.836 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 43.1 mt -138.46 121.35 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.362 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.654 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.1 mp -95.47 144.6 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.863 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 57.4 mtt180 -143.86 -174.74 4.34 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.492 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.592 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.1 m-85 -114.63 146.14 41.18 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.985 0.422 . . . . 0.0 112.051 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.61 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 4.0 p90 -139.76 153.96 47.28 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.023 -0.99 . . . . 0.0 108.731 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.501 ' CZ ' ' HA2' ' A' ' 26' ' ' GLY . 63.0 t80 -98.74 135.18 40.59 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -101.09 139.65 36.47 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 176.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -96.19 2.87 53.4 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.811 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.6 tttm -99.1 -38.1 9.07 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.53 -25.46 12.76 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.879 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.501 ' HA2' ' CZ ' ' A' ' 21' ' ' TYR . . . 67.02 53.18 28.01 Favored Glycine 0 C--N 1.348 1.244 0 C-N-CA 121.341 -0.457 . . . . 0.0 112.637 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 pp -153.17 164.71 37.57 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 122.688 0.395 . . . . 0.0 111.012 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 92.3 m -99.51 109.2 21.76 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.15 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.592 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -97.64 157.64 15.93 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.708 -178.852 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.519 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 34.6 p -87.78 130.09 34.97 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.517 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.61 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 7.5 p90 -152.36 152.64 32.32 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.214 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.654 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.1 t -77.44 161.38 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 C-N-CA 123.628 0.771 . . . . 0.0 112.545 -177.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.648 ' OH ' ' HB1' ' A' ' 38' ' ' ALA . 12.3 t80 -132.1 143.1 49.77 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.571 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.483 ' N ' HG23 ' A' ' 9' ' ' THR . . . -100.09 -161.1 28.47 Favored Glycine 0 C--N 1.337 0.597 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.113 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -144.06 3.26 1.47 Allowed Glycine 0 C--N 1.341 0.818 0 C-N-CA 121.139 -0.553 . . . . 0.0 114.094 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 25.7 p -84.24 -53.5 5.45 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.461 0.63 . . . . 0.0 110.534 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.653 ' HD3' ' HE2' ' A' ' 8' ' ' TYR . 54.7 ttt-85 -102.54 -84.54 0.45 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 177.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.648 ' HB1' ' OH ' ' A' ' 33' ' ' TYR . . . 81.91 126.18 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.347 1.059 . . . . 0.0 112.173 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -112.36 -178.12 3.33 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.616 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 88.4 mtm180 -91.92 6.47 46.09 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.474 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.634 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.2 OUTLIER -96.5 76.51 2.9 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.032 0.444 . . . . 0.0 110.769 179.857 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.863 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 7.7 m120 -156.94 134.23 10.54 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.199 178.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.569 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 32.4 m-85 -134.24 105.5 6.67 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.293 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -73.27 -4.61 34.2 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.9 m -131.15 135.05 47.12 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 120.753 0.311 . . . . 0.0 111.512 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.52 -43.52 84.99 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.411 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -50.91 -56.19 13.54 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 123.667 0.605 . . . . 0.0 111.279 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -64.91 -48.93 72.39 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 116.682 -0.236 . . . . 0.0 110.443 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.568 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 43.1 t -48.02 -47.15 33.64 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 123.729 0.643 . . . . 0.0 111.336 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.19 -42.74 71.97 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.311 0.244 . . . . 0.0 111.405 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -69.5 -15.05 63.18 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.6 m -107.38 -51.88 2.85 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 122.952 0.158 . . . . 0.0 111.297 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.568 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.8 OUTLIER -111.11 18.33 19.5 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -178.967 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.798 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.478 178.681 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.511 0.196 . . . . 0.0 111.158 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.551 ' CD2' ' HB3' ' A' ' 40' ' ' ARG . 3.7 p90 -111.18 149.27 31.17 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.125 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.5 t 175.35 -39.52 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.255 0.622 . . . . 0.0 110.864 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.464 ' HG ' ' CB ' ' A' ' 23' ' ' ALA . 6.1 mp -87.43 17.78 4.28 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 123.402 0.439 . . . . 0.0 111.862 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.464 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 5.8 mm-40 -96.16 122.52 57.81 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.077 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 2.8 Cg_exo -76.71 165.62 28.45 Favored 'Trans proline' 0 C--N 1.368 1.577 0 C-N-CA 123.062 2.508 . . . . 0.0 112.558 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.595 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 28.3 Cg_endo -55.08 135.63 69.63 Favored 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 123.372 2.715 . . . . 0.0 113.386 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.407 ' C ' ' H ' ' A' ' 10' ' ' GLY . 2.7 t80 -95.95 28.67 3.03 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.972 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.646 HG23 HG11 ' A' ' 32' ' ' VAL . 14.1 m -49.65 -4.86 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . -27.09 131.35 0.04 OUTLIER Glycine 0 N--CA 1.477 1.399 0 CA-C-O 118.219 -1.323 . . . . 0.0 112.42 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -16.91 77.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.076 1 C-N-CA 125.664 4.243 . . . . 0.0 116.013 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.6 m -134.09 176.52 8.51 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.358 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -87.27 55.44 3.54 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.891 0.853 . . . . 0.0 109.941 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.65 ' HA ' ' HA2' ' A' ' 34' ' ' GLY . . . -80.95 113.44 19.16 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.857 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.689 ' O ' HG13 ' A' ' 16' ' ' ILE . 5.8 tpm_? -133.71 33.33 3.49 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.723 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.689 HG13 ' O ' ' A' ' 15' ' ' ARG . 31.4 mt -154.94 113.83 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.43 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 1.048 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.8 mp -91.42 115.63 30.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 122.312 1.053 . . . . 0.0 109.902 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.734 ' N ' ' O ' ' A' ' 31' ' ' PHE . 2.2 mmp_? -100.8 -156.12 0.54 Allowed 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 112.428 -2.169 . . . . 0.0 110.081 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 4.8 m-85 -123.75 166.7 15.11 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.822 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 8.4 p90 -162.91 170.96 17.34 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.168 176.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.633 ' HB2' ' SG ' ' A' ' 49' ' ' CYS . 0.8 OUTLIER -115.74 107.91 15.67 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.479 0.312 . . . . 0.0 111.408 -178.852 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.53 ' ND2' ' HB2' ' A' ' 29' ' ' GLN . 65.5 m-80 -76.49 97.55 4.36 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-O 121.451 0.643 . . . . 0.0 112.064 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.464 ' CB ' ' HG ' ' A' ' 4' ' ' LEU . . . -76.62 24.07 0.15 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.881 177.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.5 ' H ' ' C ' ' A' ' 22' ' ' ASN . 12.7 tmtt? -98.73 -39.95 8.39 Favored 'General case' 0 C--N 1.35 0.624 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 177.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 -51.75 2.84 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.422 -1.263 . . . . 0.0 109.988 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.2 -35.18 1.59 Allowed Glycine 0 C--N 1.348 1.247 0 C-N-CA 121.246 -0.502 . . . . 0.0 112.972 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 pp -87.68 169.28 12.26 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 94.7 m -98.84 139.91 33.81 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.386 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.53 ' HB2' ' ND2' ' A' ' 22' ' ' ASN . 67.7 mt-30 -132.73 158.76 41.57 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 123.466 0.479 . . . . 0.0 110.98 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 19' ' ' TYR . 45.1 p -85.65 121.44 28.33 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.734 ' O ' ' N ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -113.54 178.81 4.15 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 176.682 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 1.048 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.3 p -91.4 -159.16 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 118.794 0.724 . . . . 0.0 110.897 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.785 ' H ' HG22 ' A' ' 32' ' ' VAL . 77.2 t80 -173.49 111.34 0.19 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.514 1.125 . . . . 0.0 108.564 177.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.65 ' HA2' ' HA ' ' A' ' 14' ' ' ALA . . . -92.59 163.26 27.2 Favored Glycine 0 C--N 1.336 0.571 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.743 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.31 26.42 11.83 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 121.372 -0.442 . . . . 0.0 113.133 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -95.59 -51.02 4.71 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 122.185 0.194 . . . . 0.0 111.072 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 -145.18 139.8 27.49 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.317 0.385 . . . . 0.0 111.441 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -99.69 118.63 36.61 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.769 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.76 -171.46 2.06 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.236 0.541 . . . . 0.0 111.078 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.551 ' HB3' ' CD2' ' A' ' 2' ' ' PHE . 40.1 mmt180 -82.38 -74.5 0.34 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.428 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.464 ' HB2' ' HB2' ' A' ' 5' ' ' GLU . 0.3 OUTLIER -51.71 101.94 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -148.67 136.19 20.46 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 114.022 -1.445 . . . . 0.0 109.311 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.822 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 59.4 m-85 -138.17 150.07 46.44 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.572 ' HG3' ' NH1' ' A' ' 18' ' ' ARG . 0.7 OUTLIER -97.23 -46.02 6.29 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 114.684 -1.144 . . . . 0.0 111.922 -179.594 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.496 ' HB2' ' OD2' ' A' ' 48' ' ' ASP . 52.9 m -133.3 168.09 19.21 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.199 0.312 . . . . 0.0 111.603 -179.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.439 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -63.25 -64.69 0.83 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.875 0.47 . . . . 0.0 111.814 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.474 ' O ' ' HD2' ' A' ' 51' ' ' ARG . 97.9 mt-10 -53.17 -34.75 58.23 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.809 0.444 . . . . 0.0 111.836 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.496 ' OD2' ' HB2' ' A' ' 45' ' ' SER . 54.8 m-20 -73.52 -33.32 64.7 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.269 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.661 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 33.9 t -63.84 -47.55 80.32 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.914 178.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.413 ' HB3' ' NH2' ' A' ' 51' ' ' ARG . 74.7 mtm -69.6 -48.22 60.87 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.478 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.474 ' HD2' ' O ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -64.17 -30.41 71.47 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.421 ' HB ' ' HE1' ' A' ' 43' ' ' PHE . 31.0 m -90.69 -32.0 16.36 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.56 ' HB3' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -80.85 -51.95 8.03 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 117.856 0.298 . . . . 0.0 111.008 -179.782 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 0.983 0 C-N-CA 121.358 -0.449 . . . . 0.0 112.61 -179.707 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.598 0.237 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -138.52 -32.22 0.71 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.397 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.9 t -77.25 -20.3 55.37 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.855 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.0 pp -88.05 23.78 2.0 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 120.952 0.406 . . . . 0.0 111.874 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -96.01 155.31 38.42 Favored Pre-proline 0 CA--C 1.537 0.447 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.784 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.3 141.45 81.94 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.675 2.25 . . . . 0.0 113.452 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.527 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 29.1 Cg_endo -54.81 133.87 59.86 Favored 'Trans proline' 0 C--N 1.372 1.766 0 C-N-CA 123.968 3.112 . . . . 0.0 114.029 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -135.54 103.53 5.49 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.592 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.678 HG23 ' HA ' ' A' ' 33' ' ' TYR . 28.5 m -96.49 -78.06 0.47 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.26 146.81 9.38 Favored Glycine 0 C--N 1.342 0.898 0 CA-C-O 119.117 -0.824 . . . . 0.0 111.636 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.515 ' HD2' HH22 ' A' ' 37' ' ' ARG . 7.9 Cg_exo -72.35 68.9 3.4 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.882 2.388 . . . . 0.0 112.247 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.9 m -124.9 -152.8 0.53 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.827 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -87.25 57.65 4.58 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.834 0.826 . . . . 0.0 110.182 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.622 ' HA ' ' HA2' ' A' ' 34' ' ' GLY . . . -85.26 116.17 23.45 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.697 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.502 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 3.4 ppt_? -142.16 21.77 2.08 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.046 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.5 mt -131.96 116.05 29.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.223 -178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.863 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.7 mp -92.83 106.68 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 122.267 1.032 . . . . 0.0 109.355 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.617 ' N ' ' O ' ' A' ' 31' ' ' PHE . 51.2 mtt180 -98.2 174.58 6.44 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 112.825 -1.989 . . . . 0.0 110.955 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.53 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 1.5 m-85 -110.73 152.11 26.96 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.625 0.25 . . . . 0.0 111.093 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.587 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 2.4 p90 -139.83 157.46 45.68 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.592 ' CZ ' ' HA2' ' A' ' 26' ' ' GLY . 80.9 t80 -90.71 129.83 36.76 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.734 0.302 . . . . 0.0 111.366 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.612 ' HB2' HD13 ' A' ' 27' ' ' LEU . 3.2 m120 -96.58 127.66 42.77 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.31 11.79 20.24 Favored 'General case' 0 C--O 1.239 0.526 0 O-C-N 123.416 0.447 . . . . 0.0 111.981 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -97.42 -25.04 15.34 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.651 0.262 . . . . 0.0 110.916 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.894 ' HB3' HD12 ' A' ' 27' ' ' LEU . . . -138.38 -27.37 0.87 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.731 -178.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.592 ' HA2' ' CZ ' ' A' ' 21' ' ' TYR . . . 99.09 8.66 53.45 Favored Glycine 0 C--N 1.344 1.009 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.944 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.894 HD12 ' HB3' ' A' ' 25' ' ' ALA . 0.0 OUTLIER -96.51 151.21 19.79 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.581 0.229 . . . . 0.0 111.344 -179.634 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 87.3 m -93.56 110.26 21.85 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.36 178.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.587 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 33.1 tt0 -88.0 159.14 18.42 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.048 -177.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.44 HG22 ' CE1' ' A' ' 19' ' ' TYR . 35.5 p -96.32 128.69 43.48 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.442 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.617 ' O ' ' N ' ' A' ' 18' ' ' ARG . 7.7 p90 -152.2 152.22 31.97 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.643 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.863 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -78.33 174.28 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 C-N-CA 123.491 0.717 . . . . 0.0 111.982 -177.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.678 ' HA ' HG23 ' A' ' 9' ' ' THR . 48.0 t80 -155.99 139.5 15.89 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.352 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.622 ' HA2' ' HA ' ' A' ' 14' ' ' ALA . . . -102.59 -55.0 0.85 Allowed Glycine 0 C--N 1.338 0.685 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.187 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 98.36 27.37 8.7 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.527 -0.368 . . . . 0.0 113.319 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.6 p -95.79 -43.07 8.03 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.28 0.232 . . . . 0.0 111.545 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.515 HH22 ' HD2' ' A' ' 11' ' ' PRO . 84.4 mtm-85 -116.03 8.87 14.68 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 123.357 0.411 . . . . 0.0 111.644 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 12.2 118.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -92.7 -124.69 0.09 Allowed 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.721 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -140.46 -34.74 0.52 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 118.35 0.523 . . . . 0.0 111.47 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.441 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.4 OUTLIER -83.81 96.92 8.91 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.004 0.43 . . . . 0.0 111.789 -179.062 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.582 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 8.7 m120 -154.92 118.48 4.53 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.271 177.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.53 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 28.8 m-85 -137.96 105.69 5.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.726 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -76.36 2.45 13.45 Favored 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.5 m -135.77 132.12 36.37 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.222 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.69 -45.48 89.84 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.392 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -48.39 -55.25 11.28 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.426 0.69 . . . . 0.0 111.516 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -66.15 -45.63 80.32 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 122.449 0.3 . . . . 0.0 110.749 178.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.425 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 44.7 t -47.06 -50.38 19.75 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 123.803 0.689 . . . . 0.0 111.393 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 94.9 mtp -77.38 -35.72 54.14 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.638 0.375 . . . . 0.0 111.973 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -62.47 -28.69 69.99 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 9.8 m -104.09 -52.19 2.99 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 123.196 0.31 . . . . 0.0 110.944 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.425 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -99.45 19.71 15.12 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.31 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.874 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.433 178.661 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . 0.534 ' N ' HH22 ' A' ' 40' ' ' ARG . 47.1 t0 . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.521 0.2 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.421 ' HD1' ' SG ' ' A' ' 3' ' ' CYS . 12.3 p90 -130.94 -171.19 2.51 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.936 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 67.8 m 72.54 -51.56 0.7 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.379 1.071 . . . . 0.0 112.698 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 57.6 mt -79.35 -11.96 59.93 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -95.04 146.49 31.41 Favored Pre-proline 0 CA--C 1.535 0.398 0 O-C-N 123.18 0.3 . . . . 0.0 110.388 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.17 163.0 30.59 Favored 'Trans proline' 0 C--N 1.369 1.631 0 C-N-CA 122.804 2.336 . . . . 0.0 112.725 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.527 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 55.4 Cg_endo -62.44 153.11 73.13 Favored 'Trans proline' 0 C--N 1.373 1.823 0 C-N-CA 123.009 2.473 . . . . 0.0 112.448 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.738 ' HE2' ' HD3' ' A' ' 37' ' ' ARG . 2.0 t80 -88.31 22.15 2.59 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.698 HG22 ' HG3' ' A' ' 13' ' ' LYS . 7.1 m -55.6 -5.86 0.16 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.94 0.496 . . . . 0.0 111.789 178.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.421 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . -28.7 -90.52 0.01 OUTLIER Glycine 0 C--N 1.352 1.472 0 C-N-CA 124.253 0.93 . . . . 0.0 114.446 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -89.58 14.37 2.18 Favored 'Trans proline' 0 C--N 1.362 1.273 0 C-N-CA 122.933 2.422 . . . . 0.0 113.38 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.1 m -137.97 122.49 18.46 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 120.603 0.24 . . . . 0.0 110.883 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' A' ' 9' ' ' THR . 0.3 OUTLIER -141.53 82.66 1.83 Allowed 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.865 179.725 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.86 -170.83 2.68 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.175 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.65 38.09 1.88 Allowed 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.041 0.448 . . . . 0.0 112.133 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.5 mt -129.96 102.02 6.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.482 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.923 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 44.9 mm -91.26 144.29 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.772 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.8 ' N ' ' O ' ' A' ' 31' ' ' PHE . 4.0 ttt180 -134.8 -154.78 0.61 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.657 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.497 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 10.6 m-85 -120.33 156.36 31.47 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.292 0.496 . . . . 0.0 111.73 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.581 ' HD1' ' O ' ' A' ' 29' ' ' GLN . 0.1 OUTLIER -164.75 179.91 6.27 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 114.838 -1.073 . . . . 0.0 112.131 177.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.434 ' CD1' ' HB2' ' A' ' 53' ' ' CYS . 63.6 t80 -94.76 168.74 10.63 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -142.95 123.54 14.05 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 120.056 1.298 . . . . 0.0 109.953 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.63 12.99 6.13 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.603 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -98.35 -39.04 9.0 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-O 121.035 0.445 . . . . 0.0 110.477 178.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.06 -35.65 5.6 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.388 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.06 -39.4 2.68 Favored Glycine 0 C--N 1.341 0.85 0 O-C-N 123.48 0.488 . . . . 0.0 112.615 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.755 HD23 ' H ' ' A' ' 27' ' ' LEU . 1.2 pt? -82.59 -163.83 0.76 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 98.3 m -111.0 144.91 39.36 Favored 'General case' 0 C--N 1.347 0.469 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.357 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.581 ' O ' ' HD1' ' A' ' 20' ' ' PHE . 3.2 tp-100 -144.44 169.24 18.31 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.611 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.8 p -87.09 126.94 35.09 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -178.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.8 ' O ' ' N ' ' A' ' 18' ' ' ARG . 1.8 p90 -122.64 170.93 9.53 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.247 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.923 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.5 p -76.14 -161.74 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 C-N-CA 123.449 0.699 . . . . 0.0 111.35 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.743 ' H ' HG22 ' A' ' 32' ' ' VAL . 71.2 t80 179.39 117.78 0.05 OUTLIER 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.681 1.192 . . . . 0.0 108.947 178.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -115.53 148.51 18.91 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.34 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -86.13 46.97 3.69 Favored Glycine 0 C--N 1.34 0.755 0 C-N-CA 121.499 -0.381 . . . . 0.0 112.33 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.7 p -95.19 -46.25 6.85 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.873 0.396 . . . . 0.0 111.34 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.738 ' HD3' ' HE2' ' A' ' 8' ' ' TYR . 53.9 ttt-85 -137.9 -36.97 0.6 Allowed 'General case' 0 CA--C 1.536 0.424 0 O-C-N 123.372 0.42 . . . . 0.0 111.216 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 63.47 116.03 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.59 0.756 . . . . 0.0 111.725 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.5 mmtt -105.46 -163.67 0.96 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.423 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.534 HH22 ' N ' ' A' ' 1' ' ' ASP . 89.1 mtm180 -82.38 -76.08 0.28 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.46 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.426 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.4 OUTLIER -39.65 99.2 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -177.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -148.8 129.02 13.69 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 114.254 -1.339 . . . . 0.0 110.155 177.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.497 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 84.4 m-85 -134.19 148.02 50.84 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -98.47 -41.31 7.84 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.671 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.4 m -132.32 163.56 28.38 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.75 -55.51 29.41 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.194 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.463 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 60.4 mp0 -52.18 -28.63 18.96 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -80.38 -39.1 29.07 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.458 ' HA ' ' CE1' ' A' ' 43' ' ' PHE . 36.3 t -67.01 -24.06 65.98 Favored 'General case' 0 C--N 1.35 0.622 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.661 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.462 ' O ' ' N ' ' A' ' 54' ' ' GLY . 94.8 mtp -81.29 -55.99 4.36 Favored 'General case' 0 C--N 1.348 0.541 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 99.3 mtt180 -45.66 -37.4 5.69 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.823 0.449 . . . . 0.0 111.483 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.8 m -90.28 -58.53 2.47 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 123.483 0.489 . . . . 0.0 110.044 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -121.34 62.46 0.9 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.462 ' N ' ' O ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.336 0.537 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.574 179.894 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.556 0.217 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.45 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 3.0 p90 -118.66 -158.96 0.74 Allowed 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.115 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 56.0 m 73.03 -51.26 0.71 Allowed 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.346 1.058 . . . . 0.0 111.891 -179.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 23' ' ' ALA . 4.4 mm? -80.11 -2.2 43.47 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.727 0.411 . . . . 0.0 111.892 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -94.1 155.21 40.31 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.721 179.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -67.02 148.56 81.86 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.826 2.351 . . . . 0.0 112.945 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.511 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 38.3 Cg_endo -58.97 138.62 86.69 Favored 'Trans proline' 0 C--N 1.371 1.739 0 C-N-CA 123.624 2.882 . . . . 0.0 113.884 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.548 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 32.0 t80 -128.78 95.51 4.12 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.238 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.2 m -95.22 -70.8 0.7 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.563 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.2 160.23 23.39 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-O 119.288 -0.729 . . . . 0.0 112.141 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.99 64.21 6.03 Favored 'Trans proline' 0 C--N 1.369 1.644 0 C-N-CA 122.937 2.424 . . . . 0.0 112.753 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.6 m -132.0 -65.25 0.75 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.756 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.5 mptt 53.07 87.1 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.078 0.951 . . . . 0.0 112.342 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.519 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -87.28 48.92 1.72 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.255 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.2 OUTLIER 43.05 36.55 0.95 Allowed 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 178.87 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 38.1 mt -132.35 141.64 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.966 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.817 HG13 HG22 ' A' ' 32' ' ' VAL . 5.0 mp -117.85 103.33 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 122.159 0.981 . . . . 0.0 108.513 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.607 ' N ' ' O ' ' A' ' 31' ' ' PHE . 19.2 mtt180 -90.77 -169.04 2.24 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 113.106 -1.861 . . . . 0.0 111.404 -179.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.491 ' CE2' ' HB2' ' A' ' 46' ' ' ALA . 10.6 m-85 -124.84 158.96 32.16 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 122.334 0.254 . . . . 0.0 110.898 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.541 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 7.6 p90 -157.48 169.13 25.41 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 177.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.727 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 64.6 t80 -94.74 116.51 28.83 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.797 0.332 . . . . 0.0 110.955 179.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.595 HD21 ' HB2' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -98.69 83.68 3.01 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.542 179.443 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.52 ' HB2' HD13 ' A' ' 4' ' ' LEU . . . -55.68 -3.31 0.07 Allowed 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -179.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -96.48 -29.73 13.74 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . 0.46 ' HB3' ' HB2' ' A' ' 22' ' ' ASN . . . -89.96 -33.4 16.4 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.85 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.21 -15.9 15.4 Favored Glycine 0 C--N 1.344 0.984 0 C-N-CA 121.055 -0.593 . . . . 0.0 114.274 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 pp -154.26 -169.71 3.32 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 117.436 0.618 . . . . 0.0 111.737 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 58.8 m -81.7 139.82 34.68 Favored 'General case' 0 C--N 1.35 0.614 0 C-N-CA 122.867 0.467 . . . . 0.0 111.088 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.595 ' HB2' HD21 ' A' ' 22' ' ' ASN . 70.1 mt-30 -131.45 157.74 42.68 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.47 0.652 . . . . 0.0 112.653 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -77.81 130.14 36.32 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 113.382 -1.735 . . . . 0.0 111.766 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.607 ' O ' ' N ' ' A' ' 18' ' ' ARG . 5.9 p90 -150.93 151.59 32.37 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.299 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.817 HG22 HG13 ' A' ' 17' ' ' ILE . 20.7 t -76.59 125.19 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.833 0.853 . . . . 0.0 110.922 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.557 ' CG ' ' HD2' ' A' ' 18' ' ' ARG . 51.8 t80 -103.32 155.27 18.59 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.995 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.467 ' HA2' ' H ' ' A' ' 14' ' ' ALA . . . -105.8 -58.62 0.63 Allowed Glycine 0 C--N 1.336 0.566 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.496 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 87.33 17.95 58.05 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 121.473 -0.394 . . . . 0.0 113.004 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 25.5 p -95.05 -38.39 10.66 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 122.565 0.346 . . . . 0.0 111.245 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.409 ' HD3' ' OH ' ' A' ' 8' ' ' TYR . 59.9 ttt180 -126.92 29.68 5.6 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 123.411 0.444 . . . . 0.0 110.581 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -18.61 130.66 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.548 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 17.3 tptm -108.32 -132.57 0.32 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.424 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -123.35 -54.61 1.78 Allowed 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.578 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.2 OUTLIER -66.54 80.22 0.1 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.247 0.546 . . . . 0.0 111.372 -179.47 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.468 ' ND2' ' HZ ' ' A' ' 31' ' ' PHE . 10.2 m120 -157.69 142.88 16.9 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.238 178.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -133.41 154.18 50.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.963 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -97.65 -46.94 5.81 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.04 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.7 t -112.95 150.48 31.79 Favored 'General case' 0 C--O 1.241 0.625 0 O-C-N 123.486 0.492 . . . . 0.0 111.509 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.491 ' HB2' ' CE2' ' A' ' 19' ' ' TYR . . . -68.04 -38.19 82.21 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.819 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 67.4 tt0 -57.25 -42.94 82.48 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 123.499 0.499 . . . . 0.0 110.998 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -70.6 -54.74 10.85 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.203 178.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 14.1 t -54.64 -29.69 53.05 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.463 0.477 . . . . 0.0 111.992 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.559 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 53.0 mtt -77.9 -47.96 17.48 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 122.819 0.448 . . . . 0.0 111.105 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 99.4 mtt180 -59.82 -30.88 69.23 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.398 0.436 . . . . 0.0 111.675 179.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.7 m -89.24 -55.81 3.52 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.727 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 2.7 p -138.98 68.58 1.38 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.015 0.436 . . . . 0.0 111.593 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.559 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.339 0.727 0 C-N-CA 121.086 -0.578 . . . . 0.0 112.466 179.986 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 120.519 0.199 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.844 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 6.5 p90 -95.78 5.87 50.28 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.977 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.6 t -86.16 -11.26 53.04 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.797 0.439 . . . . 0.0 111.289 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.756 ' HA ' ' HB2' ' A' ' 23' ' ' ALA . 50.9 mt -125.08 -4.01 7.5 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.821 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -93.77 146.92 32.63 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.464 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -78.76 162.81 26.75 Favored 'Trans proline' 0 C--N 1.371 1.739 0 C-N-CA 123.327 2.685 . . . . 0.0 112.915 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.622 ' HD3' ' HE2' ' A' ' 20' ' ' PHE . 66.8 Cg_endo -66.35 159.75 48.68 Favored 'Trans proline' 0 C--N 1.374 1.895 0 C-N-CA 123.202 2.601 . . . . 0.0 113.727 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.51 ' HB3' ' HG2' ' A' ' 39' ' ' LYS . 54.0 t80 -137.17 83.85 2.02 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.573 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.6 m -95.86 -55.88 2.85 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.232 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.89 -159.07 29.97 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 119.303 -0.721 . . . . 0.0 112.731 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -75.48 -1.1 10.9 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 123.017 2.478 . . . . 0.0 113.058 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.13 142.9 26.99 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.634 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -140.32 89.85 2.32 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.7 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.498 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -78.03 176.1 9.48 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.824 -179.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.503 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 0.1 OUTLIER -105.1 25.98 9.88 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.16 0.505 . . . . 0.0 111.823 -179.045 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 12.2 mt -127.66 86.76 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.571 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 1.011 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.6 mp -82.74 145.0 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.423 0.63 . . . . 0.0 109.798 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.483 HH21 ' HB3' ' A' ' 33' ' ' TYR . 5.8 ttm-85 -139.6 -161.46 1.19 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.22 -1.355 . . . . 0.0 110.395 -177.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.471 ' CE1' HG22 ' A' ' 30' ' ' THR . 3.9 m-85 -119.24 165.6 14.03 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 120.626 0.25 . . . . 0.0 111.52 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.622 ' HE2' ' HD3' ' A' ' 7' ' ' PRO . 1.6 p90 -166.08 -178.27 4.57 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.397 176.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.533 ' HE2' ' SD ' ' A' ' 50' ' ' MET . 34.7 t80 -125.27 130.12 51.41 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -106.52 125.46 51.03 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 120.621 0.248 . . . . 0.0 110.983 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.756 ' HB2' ' HA ' ' A' ' 4' ' ' LEU . . . -82.42 15.27 2.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.208 178.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.3 tptp -97.18 -39.92 9.05 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.503 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -102.62 -32.46 9.88 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.999 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 97.18 9.58 55.51 Favored Glycine 0 C--N 1.34 0.797 0 CA-C-N 115.904 -0.589 . . . . 0.0 114.088 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.9 ' HG ' HE22 ' A' ' 29' ' ' GLN . 0.6 OUTLIER -132.93 173.89 10.92 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 117.292 0.546 . . . . 0.0 111.479 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.501 ' SG ' ' HD2' ' A' ' 21' ' ' TYR . 72.8 m -90.2 133.64 34.78 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.775 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.9 HE22 ' HG ' ' A' ' 27' ' ' LEU . 12.6 mp0 -112.92 -162.36 0.8 Allowed 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.706 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.471 HG22 ' CE1' ' A' ' 19' ' ' TYR . 41.3 p -131.26 126.75 36.25 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.242 0.617 . . . . 0.0 109.741 178.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.541 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 2.5 p90 -145.19 149.18 34.49 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.586 -178.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 1.011 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -73.89 179.9 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 124.462 1.105 . . . . 0.0 112.251 -176.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.725 ' H ' HG12 ' A' ' 32' ' ' VAL . 50.8 t80 -158.54 135.24 9.57 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.784 0.834 . . . . 0.0 109.334 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.3 -174.27 14.18 Favored Glycine 0 C--N 1.336 0.529 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.838 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -89.56 8.51 79.68 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 121.535 -0.364 . . . . 0.0 113.029 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.452 ' HB2' ' HD2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -95.11 -52.07 4.37 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 122.724 0.409 . . . . 0.0 111.88 179.758 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.452 ' HD2' ' HB2' ' A' ' 36' ' ' CYS . 1.3 mpt_? -132.24 110.48 10.65 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.05 0.452 . . . . 0.0 111.321 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -101.08 140.92 34.71 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.801 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.51 ' HG2' ' HB3' ' A' ' 8' ' ' TYR . 6.9 mmtt -115.02 -162.18 0.81 Allowed 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.46 0.475 . . . . 0.0 110.777 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.2 mmt180 -125.16 3.54 7.89 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.863 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.844 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -119.55 100.39 7.25 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.03 0.443 . . . . 0.0 110.162 179.104 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -134.68 132.2 38.62 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.824 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.486 ' CD1' ' HA ' ' A' ' 49' ' ' CYS . 55.0 m-85 -142.53 164.72 29.36 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.004 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -99.54 -44.84 6.01 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.166 0.186 . . . . 0.0 110.89 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -136.4 161.41 35.89 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.652 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.72 -25.72 67.61 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.647 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -59.72 -70.6 0.16 Allowed 'General case' 0 N--CA 1.474 0.742 0 O-C-N 123.413 0.445 . . . . 0.0 109.849 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -58.98 -40.16 84.0 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 122.88 0.472 . . . . 0.0 110.46 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.486 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 49.7 t -52.58 -58.16 7.69 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.758 0.661 . . . . 0.0 111.559 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.533 ' SD ' ' HE2' ' A' ' 21' ' ' TYR . 5.5 mmt -64.54 -42.24 95.85 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.7 tpp85 -70.25 -24.95 63.16 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.2 m -90.46 -40.63 11.91 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 122.995 0.185 . . . . 0.0 111.392 -179.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.9 -55.09 4.0 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.342 0.902 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.625 -179.954 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.497 0.189 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.602 ' H ' ' HD1' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -130.84 -20.08 2.86 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.848 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 18.7 m -71.21 -42.76 68.56 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 122.832 0.453 . . . . 0.0 112.14 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.3 mp -79.86 -7.89 58.98 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.172 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -92.74 153.32 42.24 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.939 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -64.08 139.66 68.09 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 122.705 2.27 . . . . 0.0 113.282 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.611 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 37.6 Cg_endo -58.43 136.46 74.46 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 123.555 2.836 . . . . 0.0 114.197 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -99.45 89.12 4.07 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.217 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.5 m -96.43 -63.37 1.15 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.458 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.574 ' HA3' ' HD2' ' A' ' 37' ' ' ARG . . . 84.76 -174.93 50.29 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 119.251 -0.749 . . . . 0.0 112.338 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.584 ' HD2' ' HE ' ' A' ' 37' ' ' ARG . 3.4 Cg_exo -76.95 17.88 0.8 Allowed 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.946 2.431 . . . . 0.0 113.141 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.74 132.48 56.15 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.651 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -139.02 86.21 2.12 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.243 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.494 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -80.32 52.99 1.69 Allowed 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.973 -1.012 . . . . 0.0 112.456 -179.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.494 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.4 OUTLIER 42.13 36.2 0.67 Allowed 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 178.903 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.599 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 37.6 mt -136.46 121.6 26.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-N 116.264 -0.426 . . . . 0.0 109.86 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.765 HG13 HG22 ' A' ' 32' ' ' VAL . 4.4 mp -121.91 106.36 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 122.177 0.989 . . . . 0.0 108.799 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.66 ' HG2' ' HG2' ' A' ' 44' ' ' LYS . 33.0 mtp180 -81.88 -160.07 0.33 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 113.227 -1.806 . . . . 0.0 111.178 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.561 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 15.7 m-85 -129.81 113.5 14.77 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.573 ' HA ' ' CB ' ' A' ' 42' ' ' ASN . 4.8 p90 -106.87 -174.59 2.57 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.644 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -128.42 134.72 48.85 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.326 0.107 . . . . 0.0 110.924 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -106.57 107.4 18.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.29 -2.73 6.43 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -96.38 -34.4 11.56 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.598 0.237 . . . . 0.0 110.588 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -92.18 -41.76 10.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.0 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.08 52.04 2.66 Favored Glycine 0 C--N 1.342 0.865 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 pp -166.35 162.14 16.96 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 123.108 0.563 . . . . 0.0 111.159 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 m -94.91 111.49 23.28 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.746 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.555 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 16.8 tp60 -87.73 -163.74 0.99 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.461 -179.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.672 ' HB ' HG22 ' A' ' 17' ' ' ILE . 33.6 p -129.4 133.37 47.33 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.64 ' O ' ' N ' ' A' ' 18' ' ' ARG . 14.3 p90 -133.97 148.24 51.13 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.893 0.378 . . . . 0.0 111.569 -178.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.765 HG22 HG13 ' A' ' 17' ' ' ILE . 10.9 t -77.06 125.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 123.933 0.893 . . . . 0.0 111.791 -178.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.642 ' HE1' ' H ' ' A' ' 39' ' ' LYS . 77.5 t80 -126.53 129.16 48.08 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.108 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.427 ' HA2' ' HB3' ' A' ' 14' ' ' ALA . . . -128.04 -170.82 12.89 Favored Glycine 0 C--N 1.336 0.547 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.274 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -87.98 -9.64 70.55 Favored Glycine 0 C--N 1.341 0.811 0 O-C-N 123.735 0.314 . . . . 0.0 112.947 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.72 -34.67 27.18 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.789 0.436 . . . . 0.0 112.143 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.584 ' HE ' ' HD2' ' A' ' 11' ' ' PRO . 84.0 mtt-85 -129.58 83.87 2.17 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.504 0.668 . . . . 0.0 110.383 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -93.09 117.63 30.29 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.511 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.642 ' H ' ' HE1' ' A' ' 33' ' ' TYR . 7.4 mmtt -147.06 -174.83 4.6 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.567 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -109.75 90.2 3.24 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.611 ' ND2' ' HA ' ' A' ' 7' ' ' PRO . 0.6 OUTLIER -87.27 -68.63 0.74 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.802 -178.265 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.573 ' CB ' ' HA ' ' A' ' 20' ' ' PHE . 9.1 t-20 -150.75 -94.55 0.06 Allowed 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.488 ' CD1' ' HB3' ' A' ' 48' ' ' ASP . 66.9 m-85 -154.77 168.88 25.39 Favored 'General case' 0 C--N 1.349 0.56 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.66 ' HG2' ' HG2' ' A' ' 18' ' ' ARG . 0.6 OUTLIER -95.66 -24.56 16.5 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.288 178.587 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.487 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 26.1 t -112.53 153.68 27.1 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 120.915 0.388 . . . . 0.0 111.665 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.4 -49.63 46.97 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.442 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.2 tt0 -56.32 -34.72 66.8 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.781 0.433 . . . . 0.0 111.151 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.488 ' HB3' ' CD1' ' A' ' 43' ' ' PHE . 51.7 m-20 -72.7 -51.03 20.99 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.495 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.6 t -60.79 -30.81 70.27 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.181 178.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 63.9 mtt -75.74 -49.38 18.4 Favored 'General case' 0 C--N 1.345 0.376 0 C-N-CA 123.022 0.529 . . . . 0.0 111.434 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 48' ' ' ASP . 17.4 ptm180 -61.35 -28.01 68.91 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.8 m -92.5 -61.99 1.49 Allowed 'General case' 0 CA--C 1.549 0.91 0 O-C-N 123.281 0.363 . . . . 0.0 111.681 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -92.32 -23.71 19.18 Favored 'General case' 0 C--N 1.346 0.429 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -178.426 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.339 0.7 0 C-N-CA 120.837 -0.697 . . . . 0.0 113.043 -179.489 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 120.531 0.205 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.68 -21.26 1.73 Allowed 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -89.29 -13.84 37.14 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.744 HD23 ' HE2' ' A' ' 21' ' ' TYR . 75.2 mt -79.2 -8.5 59.06 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -95.56 153.92 39.37 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -66.34 167.0 19.64 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 123.058 2.506 . . . . 0.0 112.776 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.525 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 55.8 Cg_endo -60.87 126.0 18.56 Favored 'Trans proline' 0 C--N 1.375 1.974 0 C-N-CA 123.151 2.568 . . . . 0.0 112.542 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.536 ' CZ ' ' HD3' ' A' ' 37' ' ' ARG . 6.6 t80 -94.01 7.24 45.84 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.414 HG23 ' H ' ' A' ' 34' ' ' GLY . 7.3 m -55.79 -11.51 1.01 Allowed 'General case' 0 N--CA 1.484 1.244 0 O-C-N 122.272 -0.267 . . . . 0.0 111.615 179.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 53.14 -154.79 6.23 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.581 -0.736 . . . . 0.0 113.177 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -85.06 34.17 0.5 Allowed 'Trans proline' 0 C--N 1.367 1.505 0 C-N-CA 123.004 2.469 . . . . 0.0 112.292 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 34.5 m -87.56 -66.68 0.89 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.785 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 64.9 96.4 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.847 0.859 . . . . 0.0 111.701 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.473 ' HB2' ' HA2' ' A' ' 34' ' ' GLY . . . -91.51 -141.1 0.18 Allowed 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.185 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.523 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 2.4 ppt_? -135.21 24.28 3.52 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.163 0.506 . . . . 0.0 111.748 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.492 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 33.0 mt -132.56 102.47 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.29 -179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.944 HG13 HG22 ' A' ' 32' ' ' VAL . 3.2 mp -91.12 150.39 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 121.368 0.604 . . . . 0.0 109.596 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.82 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 17.1 mtt180 -145.21 -158.89 0.93 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.666 -178.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.608 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 5.7 m-85 -124.8 115.27 20.42 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.608 ' HB3' ' CD1' ' A' ' 31' ' ' PHE . 9.3 p90 -106.83 -167.65 1.31 Allowed 'General case' 0 CA--C 1.553 1.063 0 O-C-N 123.911 0.757 . . . . 0.0 109.565 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.744 ' HE2' HD23 ' A' ' 4' ' ' LEU . 0.8 OUTLIER -140.44 128.25 21.84 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.979 -0.451 . . . . 0.0 110.964 179.395 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -93.9 116.87 29.35 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 177.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.41 13.49 2.42 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.952 0.406 . . . . 0.0 111.31 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -97.04 -33.2 11.63 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.873 178.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.39 -47.49 3.38 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.157 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.08 -39.95 1.86 Allowed Glycine 0 C--N 1.345 1.043 0 C-N-CA 121.368 -0.444 . . . . 0.0 112.467 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.88 158.56 36.2 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -178.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.527 ' SG ' ' O ' ' A' ' 20' ' ' PHE . 35.9 t -97.49 118.86 34.93 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.047 178.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -104.78 -162.4 0.88 Allowed 'General case' 0 N--CA 1.466 0.329 0 O-C-N 122.989 0.181 . . . . 0.0 111.267 -177.565 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.603 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 37.3 p -114.38 154.81 27.42 Favored 'General case' 0 C--N 1.344 0.35 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.608 ' CD1' ' HB3' ' A' ' 20' ' ' PHE . 4.7 p90 -160.75 151.39 18.34 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.788 0.328 . . . . 0.0 110.796 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.944 HG22 HG13 ' A' ' 17' ' ' ILE . 5.8 t -87.07 136.49 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.31 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.43 ' OH ' ' HB1' ' A' ' 38' ' ' ALA . 44.0 t80 -102.18 111.27 23.48 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.701 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.473 ' HA2' ' HB2' ' A' ' 14' ' ' ALA . . . -100.06 151.55 19.18 Favored Glycine 0 C--N 1.336 0.551 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.661 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -92.29 34.17 4.57 Favored Glycine 0 C--N 1.338 0.663 0 C-N-CA 121.511 -0.375 . . . . 0.0 112.739 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.5 p -95.26 -39.9 9.83 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 122.47 0.308 . . . . 0.0 111.15 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.536 ' HD3' ' CZ ' ' A' ' 8' ' ' TYR . 88.2 mtt-85 -129.51 -50.16 1.17 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.467 0.48 . . . . 0.0 110.81 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . 0.43 ' HB1' ' OH ' ' A' ' 33' ' ' TYR . . . 60.18 136.38 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.111 0.964 . . . . 0.0 113.137 179.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -138.23 -170.77 2.88 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.397 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -104.55 52.07 0.76 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.464 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.521 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.3 OUTLIER -145.44 91.21 2.09 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.053 0.454 . . . . 0.0 110.727 179.125 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.82 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 7.5 m120 -153.68 131.5 11.62 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.117 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.608 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 35.5 m-85 -134.61 132.2 38.74 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.834 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.758 ' HD3' ' HE ' ' A' ' 18' ' ' ARG . 3.6 mmmp? -95.48 -5.1 43.7 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.889 -179.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -137.79 143.25 40.99 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.104 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.24 -53.31 38.49 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.658 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -55.14 -39.16 69.13 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.265 0.626 . . . . 0.0 111.917 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -74.34 -36.65 63.66 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 35.1 t -64.29 -27.74 69.24 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 115.074 -0.967 . . . . 0.0 110.017 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 94.1 mtp -80.55 -48.56 12.55 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.754 178.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.34 -38.65 43.15 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.128 0.571 . . . . 0.0 111.243 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.0 m -99.15 -54.72 2.89 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 123.308 0.38 . . . . 0.0 110.947 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -103.37 39.92 1.5 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -178.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.332 0.308 0 CA-C-N 116.202 -0.453 . . . . 0.0 112.5 179.194 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . 0.742 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 54.0 m-20 . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 120.488 0.185 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.548 ' O ' ' HB2' ' A' ' 41' ' ' ASN . 24.8 p90 -123.39 -34.37 3.11 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.7 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.37 -9.25 39.4 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.407 0.442 . . . . 0.0 111.017 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.742 ' HB2' ' HB3' ' A' ' 1' ' ' ASP . 2.8 mm? -83.13 -7.43 59.63 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.298 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -94.15 157.27 37.96 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 122.485 0.314 . . . . 0.0 111.244 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -62.9 171.51 5.92 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 122.943 2.429 . . . . 0.0 112.671 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.56 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 23.2 Cg_endo -53.01 133.88 53.63 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 123.515 2.81 . . . . 0.0 113.298 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.622 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 60.4 t80 -122.55 54.06 1.22 Allowed 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.261 -178.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.547 HG22 ' O ' ' A' ' 12' ' ' CYS . 20.4 m -96.08 12.59 30.08 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 36.71 -143.75 0.14 Allowed Glycine 0 CA--C 1.537 1.407 0 CA-C-N 114.287 -1.324 . . . . 0.0 114.398 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -81.13 1.8 9.04 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 123.111 2.541 . . . . 0.0 113.131 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.547 ' O ' HG22 ' A' ' 9' ' ' THR . 0.1 OUTLIER -98.12 149.11 22.86 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.879 -179.769 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -146.89 96.21 2.71 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.856 0.862 . . . . 0.0 109.381 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.558 ' CB ' ' HA2' ' A' ' 34' ' ' GLY . . . -79.4 33.92 0.25 Allowed 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.897 -1.047 . . . . 0.0 113.163 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.606 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER 44.9 26.83 0.23 Allowed 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 178.408 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 14' ' ' ALA . 28.4 mt -130.22 118.43 43.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.31 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 1.058 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 34.4 mt -81.07 139.24 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-O 121.624 0.726 . . . . 0.0 110.288 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.85 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 3.8 ttt180 -131.93 -170.49 2.41 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.927 -177.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.3 m-85 -126.3 154.06 43.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 122.487 0.315 . . . . 0.0 111.028 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.643 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 10.3 p90 -144.75 158.6 43.72 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.428 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 12.3 t80 -90.87 120.34 31.81 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -103.48 100.22 10.07 Favored 'General case' 0 C--O 1.244 0.811 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 175.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.03 16.25 0.25 Allowed 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -178.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -96.2 -26.16 15.55 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.873 178.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -116.79 -38.08 3.51 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.317 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 104.82 31.35 4.52 Favored Glycine 0 C--N 1.343 0.919 0 C-N-CA 121.276 -0.488 . . . . 0.0 113.304 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.658 ' HA ' ' SD ' ' A' ' 50' ' ' MET . 0.5 OUTLIER -152.42 168.44 25.48 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.896 0.379 . . . . 0.0 111.499 179.509 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.559 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 97.7 m -94.54 127.5 40.52 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.772 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.566 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 52.5 tp60 -94.74 159.13 15.2 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.074 -179.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 37.0 p -94.98 124.53 39.08 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.666 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.713 ' O ' ' N ' ' A' ' 18' ' ' ARG . 3.7 p90 -155.58 160.93 40.87 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.287 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 1.058 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.5 t -72.8 -179.02 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.061 0 C-N-CA 123.294 0.638 . . . . 0.0 111.87 -177.081 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.752 ' H ' HG12 ' A' ' 32' ' ' VAL . 48.7 t80 -148.71 155.76 41.45 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.037 -178.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.558 ' HA2' ' CB ' ' A' ' 14' ' ' ALA . . . -142.95 140.52 9.82 Favored Glycine 0 C--N 1.335 0.526 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.767 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -78.64 2.21 68.94 Favored Glycine 0 C--N 1.341 0.823 0 C-N-CA 121.523 -0.37 . . . . 0.0 113.036 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.56 -2.92 47.45 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -133.55 -13.33 2.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -8.81 119.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.951 1.3 . . . . 0.0 114.389 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.622 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 21.7 tptm -127.65 -108.88 0.29 Allowed 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.828 -178.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -153.27 -32.35 0.12 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.726 0.81 . . . . 0.0 111.684 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.573 HD21 ' HB2' ' A' ' 20' ' ' PHE . 14.2 t30 -67.8 -2.56 7.38 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.033 0.933 . . . . 0.0 113.396 -178.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.85 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 2.2 m120 -105.34 139.37 40.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.868 0.366 . . . . 0.0 110.716 -178.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.445 ' C ' ' HG2' ' A' ' 18' ' ' ARG . 5.5 m-85 -151.96 126.26 9.32 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.154 -178.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.76 ' HD2' ' HE ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -65.06 -39.78 93.75 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -179.774 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -99.67 128.73 45.77 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 120.987 0.422 . . . . 0.0 111.997 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.15 -41.23 99.24 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.993 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 51' ' ' ARG . 20.1 pt-20 -48.14 -55.91 9.14 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.917 0.76 . . . . 0.0 111.6 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -66.67 -45.94 77.29 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 122.457 0.303 . . . . 0.0 110.677 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.7 t -47.3 -51.91 17.8 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.809 0.693 . . . . 0.0 110.873 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.797 ' HA ' ' HE2' ' A' ' 50' ' ' MET . 8.5 mmt -74.79 -33.26 62.21 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.955 0.502 . . . . 0.0 111.573 178.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 67.0 ttt180 -60.13 -29.27 68.52 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.163 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.4 m -101.55 -52.94 3.1 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.493 0.496 . . . . 0.0 110.824 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.428 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -102.7 28.8 5.78 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -178.467 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.459 0.168 0 O-C-N 121.789 -0.569 . . . . 0.0 112.506 179.324 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.3 t70 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.517 0.199 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.674 ' HB2' ' O ' ' A' ' 40' ' ' ARG . 4.3 p90 -128.28 -6.9 5.34 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.784 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.613 ' HB3' ' HB3' ' A' ' 21' ' ' TYR . 57.0 m -72.88 -50.99 20.43 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -84.16 43.53 0.95 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.427 0.632 . . . . 0.0 112.014 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -127.17 153.77 76.79 Favored Pre-proline 0 CA--C 1.537 0.476 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.446 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.95 134.77 41.32 Favored 'Trans proline' 0 C--N 1.371 1.725 0 C-N-CA 122.549 2.166 . . . . 0.0 113.396 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -57.87 141.02 95.71 Favored 'Trans proline' 0 C--N 1.372 1.776 0 C-N-CA 123.659 2.906 . . . . 0.0 113.86 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -117.06 102.38 9.28 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.463 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.0 m -95.93 -83.0 0.38 Allowed 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.73 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.14 137.64 8.29 Favored Glycine 0 C--N 1.341 0.824 0 CA-C-O 118.933 -0.926 . . . . 0.0 110.946 -178.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.05 83.16 0.26 Allowed 'Trans proline' 0 C--N 1.37 1.685 0 C-N-CA 122.802 2.334 . . . . 0.0 112.847 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.6 m -138.2 -167.6 2.2 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.33 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -99.7 72.5 1.75 Allowed 'General case' 0 C--O 1.238 0.476 0 CA-C-O 122.195 0.998 . . . . 0.0 108.834 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.55 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -77.45 -55.63 5.22 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 113.901 -1.5 . . . . 0.0 113.104 -177.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.55 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.3 OUTLIER 46.95 22.39 0.2 Allowed 'General case' 0 N--CA 1.497 1.884 0 C-N-CA 124.523 1.129 . . . . 0.0 113.792 -179.57 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.563 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 27.4 mt -135.76 142.02 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.431 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.85 HG13 HG22 ' A' ' 32' ' ' VAL . 4.5 mp -121.23 108.61 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 122.131 0.967 . . . . 0.0 108.952 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 1.024 ' HG2' ' HA ' ' A' ' 44' ' ' LYS . 27.2 mtt180 -86.5 -167.02 1.72 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 113.116 -1.857 . . . . 0.0 111.507 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.547 ' CE2' ' HB2' ' A' ' 46' ' ' ALA . 42.4 m-85 -128.91 151.16 49.95 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.633 ' HA ' ' CB ' ' A' ' 42' ' ' ASN . 3.8 p90 -147.52 155.52 41.95 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.294 0.371 . . . . 0.0 110.669 178.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.626 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 14.9 t80 -83.7 116.89 22.88 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -178.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.538 ' C ' ' H ' ' A' ' 24' ' ' LYS . 3.2 m120 -110.56 91.11 3.53 Favored 'General case' 0 C--O 1.246 0.902 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.253 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.02 15.86 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 120.944 0.402 . . . . 0.0 111.693 -179.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . 0.538 ' H ' ' C ' ' A' ' 22' ' ' ASN . 46.5 tptt -97.78 -37.97 9.65 Favored 'General case' 0 C--N 1.345 0.372 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.18 -15.27 18.99 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.073 179.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.02 13.28 72.11 Favored Glycine 0 C--N 1.349 1.265 0 N-CA-C 114.663 0.625 . . . . 0.0 114.663 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -154.3 -176.01 5.67 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 117.307 0.554 . . . . 0.0 111.378 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 31.5 m -84.6 156.38 21.61 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.989 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.626 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 56.1 tp60 -134.78 153.78 51.88 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-O 120.961 0.41 . . . . 0.0 110.395 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.419 ' HB ' ' CG2' ' A' ' 17' ' ' ILE . 35.2 p -78.26 122.97 26.41 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.43 -179.27 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.72 ' O ' ' N ' ' A' ' 18' ' ' ARG . 3.0 p90 -141.91 142.07 33.02 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.49 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.85 HG22 HG13 ' A' ' 17' ' ' ILE . 48.3 t -78.01 126.76 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 123.984 0.914 . . . . 0.0 111.462 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.491 ' O ' ' HB1' ' A' ' 14' ' ' ALA . 42.1 t80 -112.23 131.8 55.29 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.168 179.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.474 ' HA2' ' HB2' ' A' ' 14' ' ' ALA . . . -89.64 153.59 23.36 Favored Glycine 0 C--N 1.34 0.801 0 O-C-N 123.701 0.625 . . . . 0.0 113.238 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.31 8.89 69.62 Favored Glycine 0 C--N 1.338 0.656 0 O-C-N 123.82 0.364 . . . . 0.0 113.162 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.2 p -94.94 -43.83 7.99 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 122.503 0.321 . . . . 0.0 110.876 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.3 mtt-85 -119.27 124.47 46.78 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.942 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -111.59 138.07 48.62 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.899 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.636 ' HZ2' ' HB3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -142.98 -170.72 3.31 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.859 179.575 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . 0.674 ' O ' ' HB2' ' A' ' 2' ' ' PHE . 80.4 mmt-85 -121.62 91.31 3.49 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.56 ' O ' ' HD1' ' A' ' 2' ' ' PHE . 46.3 t30 -107.57 -52.59 2.74 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.972 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.633 ' CB ' ' HA ' ' A' ' 20' ' ' PHE . 1.1 m120 -160.82 -103.01 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.447 0.467 . . . . 0.0 110.431 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.403 ' HB2' ' HB2' ' A' ' 49' ' ' CYS . 55.0 m-85 -150.96 -173.8 4.6 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -177.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 1.024 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 12.5 tppt? -97.79 -42.24 7.68 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.688 177.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.5 m -108.86 155.32 20.95 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.906 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.547 ' HB2' ' CE2' ' A' ' 19' ' ' TYR . . . -68.41 -37.35 80.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.92 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -54.35 -50.94 66.27 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.701 0.4 . . . . 0.0 111.643 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -70.52 -52.33 22.56 Favored 'General case' 0 C--N 1.345 0.39 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.969 178.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.432 ' SG ' ' ND2' ' A' ' 42' ' ' ASN . 41.9 t -49.5 -34.59 17.48 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.187 0.595 . . . . 0.0 112.309 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.613 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 59.0 mtt -78.77 -47.16 17.32 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 122.941 0.496 . . . . 0.0 111.607 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -58.05 -33.32 68.9 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 123.799 0.687 . . . . 0.0 111.58 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.9 m -86.22 -55.16 4.05 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.626 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 2.2 p -149.61 74.25 1.22 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.059 0.457 . . . . 0.0 112.118 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.613 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.339 0.715 0 C-N-CA 121.199 -0.525 . . . . 0.0 112.728 179.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 120.505 0.193 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.469 ' HE1' ' CZ ' ' A' ' 43' ' ' PHE . 1.3 p90 -125.93 -26.06 3.51 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.044 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.555 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 24.9 t -86.67 -14.15 43.42 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.222 0.326 . . . . 0.0 111.807 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.425 HD22 ' CD2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -79.67 -8.69 59.37 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 179.966 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -95.6 157.54 35.94 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -70.58 167.73 24.66 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.85 2.366 . . . . 0.0 112.523 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.498 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 37.9 Cg_endo -58.25 132.92 51.85 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 123.257 2.638 . . . . 0.0 112.968 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -92.72 -0.53 57.26 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.7 m -40.87 -22.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.901 0.88 . . . . 0.0 113.218 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 55.65 -150.92 20.75 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-O 119.409 -0.662 . . . . 0.0 113.511 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -81.9 13.17 2.56 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 123.159 2.573 . . . . 0.0 112.484 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.5 m -84.89 154.58 22.15 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.889 -179.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -133.32 73.42 1.51 Allowed 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.341 0.591 . . . . 0.0 111.19 -179.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.697 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . . . -86.92 172.26 10.18 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.411 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.856 ' HE ' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -110.79 45.14 1.18 Allowed 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.015 0.436 . . . . 0.0 111.521 -179.414 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.3 mt -131.81 92.08 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 1.141 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.1 mp -76.24 144.25 12.07 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-O 121.565 0.697 . . . . 0.0 110.131 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.95 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 68.1 mtt180 -150.56 -178.23 6.43 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.41 -177.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.83 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 1.5 m-85 -123.31 152.98 40.88 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.516 ' HB2' HD21 ' A' ' 41' ' ' ASN . 8.1 p90 -144.76 168.7 19.58 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 124.054 0.846 . . . . 0.0 109.582 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.684 ' CD2' ' HB2' ' A' ' 53' ' ' CYS . 3.8 t80 -106.86 128.87 54.66 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.418 ' ND2' ' HB2' ' A' ' 29' ' ' GLN . 69.1 m-80 -105.97 109.95 22.07 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 175.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.79 21.3 0.68 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.249 0.547 . . . . 0.0 110.805 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 tppt? -96.19 -23.74 16.58 Favored 'General case' 0 C--N 1.345 0.405 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.522 178.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -127.52 -31.15 2.52 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.198 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.415 ' HA2' ' HE1' ' A' ' 21' ' ' TYR . . . 95.44 31.29 7.6 Favored Glycine 0 C--N 1.344 0.978 0 O-C-N 123.391 0.432 . . . . 0.0 112.292 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 pp -135.72 163.53 29.96 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-O 121.007 0.432 . . . . 0.0 111.896 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.83 ' SG ' ' HB3' ' A' ' 19' ' ' TYR . 48.9 t -98.5 119.01 36.47 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.625 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.444 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 3.5 tm0? -96.16 153.01 18.03 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.563 -178.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.463 HG22 ' CZ ' ' A' ' 19' ' ' TYR . 46.2 p -90.38 123.11 33.85 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.019 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.447 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 2.6 p90 -143.08 138.05 29.63 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.701 -179.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 1.141 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.0 t -80.21 88.43 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.524 1.13 . . . . 0.0 113.009 -178.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.486 ' HB3' ' HD2' ' A' ' 18' ' ' ARG . 25.0 t80 -52.27 125.38 15.74 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.962 0.505 . . . . 0.0 110.995 178.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.697 ' HA2' ' HB3' ' A' ' 14' ' ' ALA . . . -83.26 150.46 27.34 Favored Glycine 0 C--N 1.34 0.789 0 CA-C-N 115.871 -0.604 . . . . 0.0 113.495 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.41 23.61 23.97 Favored Glycine 0 C--N 1.339 0.716 0 O-C-N 123.785 0.344 . . . . 0.0 112.898 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.9 p -95.06 -46.93 6.6 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.526 0.33 . . . . 0.0 110.451 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -126.57 126.58 43.89 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.65 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -100.93 131.42 46.81 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -145.54 165.14 29.5 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.052 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 46.9 mmm-85 -78.3 1.63 21.14 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.823 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.599 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.2 OUTLIER -89.8 72.61 7.6 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 120.924 0.393 . . . . 0.0 110.431 179.339 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.95 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 74.4 m-80 -156.7 133.69 10.37 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.718 179.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.523 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 31.9 m-85 -137.78 101.77 4.55 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.991 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.731 ' HE2' ' HE ' ' A' ' 18' ' ' ARG . 51.6 mmtt -67.13 -22.85 65.77 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.9 m -113.76 133.31 55.45 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.763 0.316 . . . . 0.0 111.834 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.93 -47.59 77.15 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.915 179.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -48.14 -56.77 7.04 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 123.918 0.761 . . . . 0.0 110.661 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . 0.705 ' HA ' ' HG2' ' A' ' 51' ' ' ARG . 57.1 m-20 -58.99 -49.66 77.04 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 122.608 0.363 . . . . 0.0 110.588 178.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.5 t -46.4 -49.74 17.59 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 123.934 0.771 . . . . 0.0 111.135 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 96.0 mtp -68.9 -43.55 75.02 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.705 ' HG2' ' HA ' ' A' ' 48' ' ' ASP . 33.3 ptt180 -70.21 -16.19 63.02 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.8 m -102.94 -49.56 3.75 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 123.209 0.318 . . . . 0.0 110.604 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.684 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 1.3 p -123.48 34.81 5.0 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.459 0.197 0 C-N-CA 121.083 -0.58 . . . . 0.0 112.458 179.884 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . 0.529 ' OD2' HD21 ' A' ' 4' ' ' LEU . 47.8 t0 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.553 0.216 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -128.5 -173.21 2.9 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.104 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.543 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 26.4 t 70.64 -47.9 0.65 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.705 1.202 . . . . 0.0 112.796 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.547 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 3.7 pp -81.85 -6.38 59.03 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . 0.442 ' HB3' ' HD2' ' A' ' 6' ' ' PRO . 55.2 mm-40 -87.32 163.85 37.89 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.562 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.442 ' HD2' ' HB3' ' A' ' 5' ' ' GLU . 13.7 Cg_endo -56.36 130.12 38.42 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.555 2.17 . . . . 0.0 113.223 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.566 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 21.4 Cg_endo -52.71 136.04 57.7 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 124.121 3.214 . . . . 0.0 114.408 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -130.1 117.49 20.05 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.612 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.422 HG23 ' HA ' ' A' ' 33' ' ' TYR . 41.2 m -96.28 -71.94 0.65 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.378 179.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.466 ' HA3' ' CB ' ' A' ' 37' ' ' ARG . . . 112.03 147.66 10.58 Favored Glycine 0 C--N 1.34 0.775 0 CA-C-O 119.146 -0.808 . . . . 0.0 111.511 -178.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.408 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 2.7 Cg_exo -76.4 49.12 2.54 Favored 'Trans proline' 0 C--N 1.368 1.553 0 C-N-CA 122.882 2.388 . . . . 0.0 113.055 -179.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . 0.69 ' HB2' ' HG2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -146.53 133.04 19.73 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.309 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.788 ' HE2' ' H ' ' A' ' 13' ' ' LYS . 0.4 OUTLIER 28.99 47.28 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 125.196 1.398 . . . . 0.0 114.549 178.796 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.652 ' HA ' ' HA2' ' A' ' 34' ' ' GLY . . . -89.52 100.25 13.09 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.913 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -155.54 30.56 0.38 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.386 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 33' ' ' TYR . 46.8 mt -143.07 128.92 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.692 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.798 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.2 mp -93.66 142.8 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.67 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 37.8 mtt180 -137.19 -176.24 4.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.678 -177.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.533 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.1 m-85 -116.64 148.03 41.36 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.686 0.279 . . . . 0.0 111.584 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.864 ' HB2' HD21 ' A' ' 41' ' ' ASN . 2.9 p90 -139.54 155.63 47.39 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.59 ' CZ ' ' HA2' ' A' ' 26' ' ' GLY . 68.4 t80 -90.38 131.97 35.86 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -99.87 130.46 46.06 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 176.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.39 9.93 27.06 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 123.349 0.406 . . . . 0.0 111.781 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -97.61 -24.74 15.39 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.048 179.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -134.97 -28.93 1.15 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.672 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.59 ' HA2' ' CZ ' ' A' ' 21' ' ' TYR . . . 95.95 8.62 57.89 Favored Glycine 0 C--N 1.342 0.914 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.297 -178.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 pp -95.7 151.61 19.21 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 123.834 0.373 . . . . 0.0 111.901 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 96.4 m -96.13 109.97 22.32 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.124 178.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.585 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 53.4 tp60 -92.15 156.94 17.0 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.031 -177.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.468 HG22 ' CE1' ' A' ' 19' ' ' TYR . 34.0 p -89.78 128.37 36.13 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.294 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.578 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 6.9 p90 -150.66 150.52 31.23 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.796 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.798 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.2 t -76.74 161.35 4.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 123.656 0.783 . . . . 0.0 112.395 -177.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.489 ' N ' ' O ' ' A' ' 16' ' ' ILE . 32.7 t80 -136.85 158.17 45.08 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.904 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.652 ' HA2' ' HA ' ' A' ' 14' ' ' ALA . . . -105.76 -164.33 23.31 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 121.146 -0.549 . . . . 0.0 113.324 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . 0.518 ' HA3' ' HB2' ' A' ' 13' ' ' LYS . . . -109.47 -60.83 0.52 Allowed Glycine 0 C--N 1.339 0.699 0 O-C-N 123.788 0.346 . . . . 0.0 112.716 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . 0.569 ' SG ' ' HD2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -80.05 -19.56 47.31 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 179.757 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.69 ' HG2' ' HB2' ' A' ' 12' ' ' CYS . 71.9 mmt-85 -96.85 102.95 14.82 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.053 0.454 . . . . 0.0 110.851 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -120.42 148.49 43.72 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.569 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.9 tmtp? -137.13 -124.78 0.14 Allowed 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.482 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -143.99 -1.24 0.98 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.781 0.433 . . . . 0.0 111.622 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.864 HD21 ' HB2' ' A' ' 20' ' ' PHE . 0.2 OUTLIER -109.15 78.48 1.14 Allowed 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.807 0.337 . . . . 0.0 111.737 -179.058 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.67 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 9.3 m120 -155.63 123.89 5.85 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.81 177.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 36.5 m-85 -134.65 103.32 5.61 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.138 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.434 ' HG2' ' HG2' ' A' ' 18' ' ' ARG . 6.5 tmtt? -74.31 0.62 13.73 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.2 m -134.92 134.22 40.4 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.269 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.93 -45.99 86.75 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.295 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -49.11 -55.96 10.6 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.781 0.676 . . . . 0.0 110.786 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -62.53 -47.45 83.84 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 122.398 0.279 . . . . 0.0 110.763 178.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.506 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 53.7 t -46.68 -48.96 20.0 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 123.824 0.702 . . . . 0.0 111.37 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.5 mtt -73.69 -39.26 64.51 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 86.8 mtm180 -69.13 -19.76 64.03 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.5 m -105.72 -51.49 2.99 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 122.983 0.177 . . . . 0.0 110.841 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.506 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.2 OUTLIER -109.42 21.04 17.55 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -178.681 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.755 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.545 178.589 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 N--CA 1.488 1.468 0 CA-C-O 120.519 0.2 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -127.82 -164.87 1.41 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.238 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . 0.722 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 13.9 t 72.51 -39.66 0.45 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.808 1.243 . . . . 0.0 112.35 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.435 HD23 ' CD1' ' A' ' 21' ' ' TYR . 23.1 mt -79.51 -4.95 53.67 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -95.14 151.37 38.74 Favored Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.198 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . 0.408 ' HA ' ' HE2' ' A' ' 20' ' ' PHE . 39.2 Cg_endo -67.18 169.34 15.43 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.927 2.418 . . . . 0.0 112.908 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . 0.585 ' HD3' ' CZ ' ' A' ' 20' ' ' PHE . 36.5 Cg_endo -57.81 130.01 36.35 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 123.037 2.491 . . . . 0.0 113.101 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.959 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 9.9 t80 -95.22 -19.76 19.77 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.592 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.6 m -8.94 -80.67 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.613 0.765 . . . . 0.0 109.609 -176.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.39 -159.47 19.01 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.611 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -78.72 13.07 2.0 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 123.073 2.515 . . . . 0.0 113.143 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.6 m -94.85 -59.53 1.89 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.928 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt 57.51 91.23 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.095 0.958 . . . . 0.0 112.33 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . 0.504 ' CB ' ' HA2' ' A' ' 34' ' ' GLY . . . -80.98 -158.33 0.2 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.402 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.68 37.71 4.25 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.071 0.462 . . . . 0.0 111.814 -179.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.0 mt -129.96 91.74 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.712 -179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.894 HG13 HG22 ' A' ' 32' ' ' VAL . 2.9 mp -76.39 153.87 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.079 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.628 HH11 ' ND2' ' A' ' 42' ' ' ASN . 39.2 mtt180 -154.8 -179.59 8.17 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.625 -177.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.749 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 2.2 m-85 -112.39 156.91 21.72 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-N 118.32 0.509 . . . . 0.0 111.731 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.585 ' CZ ' ' HD3' ' A' ' 7' ' ' PRO . 1.8 p90 -158.56 167.05 30.63 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 124.597 1.186 . . . . 0.0 108.981 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.722 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 5.5 t80 -81.71 133.8 35.39 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 118.419 0.554 . . . . 0.0 112.166 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . 0.568 ' ND2' ' HB3' ' A' ' 29' ' ' GLN . 67.8 m-80 -141.27 112.88 7.61 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.104 178.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.92 7.28 4.99 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.0 177.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -96.87 -41.04 8.63 Favored 'General case' 0 C--N 1.348 0.537 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.017 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.44 -48.05 9.37 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.981 179.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 169.49 -62.54 0.18 Allowed Glycine 0 C--N 1.336 0.576 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.659 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.726 HD12 ' N ' ' A' ' 28' ' ' CYS . 2.3 pp -150.62 -52.49 0.14 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.368 0.267 . . . . 0.0 110.822 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . 0.726 ' N ' HD12 ' A' ' 27' ' ' LEU . 58.5 m -133.86 144.64 49.05 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.538 0.335 . . . . 0.0 110.24 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.568 ' HB3' ' ND2' ' A' ' 22' ' ' ASN . 63.3 tp60 -145.81 159.23 43.5 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.405 0.622 . . . . 0.0 112.273 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 34.9 p -77.54 142.28 39.12 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 113.946 -1.479 . . . . 0.0 112.244 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.599 ' O ' ' N ' ' A' ' 18' ' ' ARG . 6.7 p90 -152.64 147.35 26.04 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.388 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.894 HG22 HG13 ' A' ' 17' ' ' ILE . 3.2 t -99.13 110.37 26.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.241 0.617 . . . . 0.0 111.363 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.426 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 48.8 t80 -78.49 136.07 37.5 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . 0.504 ' HA2' ' CB ' ' A' ' 14' ' ' ALA . . . -92.59 155.59 22.75 Favored Glycine 0 C--N 1.338 0.664 0 O-C-N 123.561 0.538 . . . . 0.0 112.906 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -98.66 11.95 62.87 Favored Glycine 0 C--N 1.337 0.625 0 C-N-CA 121.433 -0.413 . . . . 0.0 113.346 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 17.5 p -95.14 -44.61 7.56 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.771 0.285 . . . . 0.0 110.73 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -124.76 153.49 42.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.025 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -100.6 151.02 22.1 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.276 0.56 . . . . 0.0 112.161 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.959 ' HD3' ' HB3' ' A' ' 8' ' ' TYR . 13.0 ttpp -134.07 165.18 25.66 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.356 -179.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 86.4 mtm180 -112.47 18.7 18.23 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.648 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.919 ' H ' ' HG2' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -126.96 97.45 4.97 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.172 0.51 . . . . 0.0 110.936 179.751 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.628 ' ND2' HH11 ' A' ' 18' ' ' ARG . 8.3 m120 -146.23 147.93 31.95 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.543 178.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.749 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 56.1 m-85 -160.53 81.19 0.67 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.759 0.662 . . . . 0.0 109.853 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . 0.519 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 20.2 tptm -43.25 -28.04 0.28 Allowed 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -178.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.4 m -136.65 154.91 50.51 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.666 0.269 . . . . 0.0 111.636 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -59.62 -50.62 73.17 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.51 179.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.489 ' O ' ' HB2' ' A' ' 51' ' ' ARG . 71.8 tt0 -43.63 -51.13 7.18 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.931 0.77 . . . . 0.0 110.474 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -66.07 -39.14 89.82 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.42 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.456 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 41.9 t -55.5 -59.24 5.11 Favored 'General case' 0 C--N 1.355 0.843 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . 0.524 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 66.9 mtt -60.97 -31.96 71.52 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 122.884 0.474 . . . . 0.0 111.011 177.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 5.4 tmm_? -58.11 -41.94 84.65 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.57 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.433 ' HB ' ' CZ ' ' A' ' 43' ' ' PHE . 7.6 m -101.24 -51.31 3.54 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.13 12.04 37.4 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -178.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . 0.524 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . . . . . . 0 C--N 1.341 0.841 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.581 179.279 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.532 0.206 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' PHE . . . . . 0.507 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 2.5 p90 -104.57 -29.76 10.44 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.926 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -83.57 -35.69 24.54 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LEU . . . . . 0.559 ' HA ' ' HB2' ' A' ' 23' ' ' ALA . 4.3 mm? -80.54 -8.18 59.49 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.547 179.083 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -112.26 155.39 43.65 Favored Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.395 179.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -61.52 142.83 96.3 Favored 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 122.706 2.27 . . . . 0.0 113.392 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -61.56 165.35 13.61 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 123.522 2.815 . . . . 0.0 113.395 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . 0.744 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 15.1 t80 -125.57 35.18 4.77 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.623 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 32' ' ' VAL . 7.0 m -57.92 -41.69 83.22 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.093 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' GLY . . . . . 0.637 ' HA3' ' NE ' ' A' ' 37' ' ' ARG . . . 70.91 -165.17 53.14 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.318 -0.712 . . . . 0.0 113.027 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PRO . . . . . 0.466 ' HD3' HH21 ' A' ' 37' ' ' ARG . 3.0 Cg_exo -80.83 16.75 1.54 Allowed 'Trans proline' 0 C--N 1.368 1.566 0 C-N-CA 123.052 2.501 . . . . 0.0 112.824 179.433 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.77 114.86 22.78 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.624 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -142.04 83.23 1.83 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.154 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.44 -104.44 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ARG . . . . . 0.558 ' HD3' ' N ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -137.98 34.36 2.37 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.044 0.45 . . . . 0.0 112.197 -178.428 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ILE . . . . . 0.535 ' HB ' ' O ' ' A' ' 33' ' ' TYR . 23.1 mt -127.54 61.92 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-O 121.801 0.81 . . . . 0.0 109.62 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ILE . . . . . 0.947 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.5 mp -69.82 126.7 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.57 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ARG . . . . . 0.968 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 71.2 mtt180 -127.64 -179.73 5.08 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 113.032 -1.895 . . . . 0.0 108.805 -179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' TYR . . . . . 0.673 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.5 m-85 -111.45 153.92 25.43 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -177.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . 0.586 ' CE2' ' HB3' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -142.98 145.15 32.69 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 178.465 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' TYR . . . . . 0.482 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 44.9 t80 -101.39 119.21 38.41 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.21 93.72 5.92 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ALA . . . . . 0.559 ' HB2' ' HA ' ' A' ' 4' ' ' LEU . . . -56.9 -13.32 2.54 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 tttm -95.55 -34.65 11.95 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 118.401 0.546 . . . . 0.0 110.942 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -79.62 -31.42 41.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.914 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.6 -15.23 61.26 Favored Glycine 0 C--N 1.34 0.785 0 O-C-N 123.414 0.446 . . . . 0.0 112.999 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LEU . . . . . 0.604 HD13 ' H ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -115.55 170.64 8.27 Favored 'General case' 0 C--O 1.244 0.764 0 CA-C-O 121.141 0.496 . . . . 0.0 112.122 -179.395 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.5 t -93.55 157.64 16.09 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.154 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' GLN . . . . . 0.586 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 25.2 tt0 -144.88 130.95 19.37 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.172 -178.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.3 p -77.33 139.65 39.82 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PHE . . . . . 0.616 ' O ' ' N ' ' A' ' 18' ' ' ARG . 18.4 p90 -138.13 159.41 42.1 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.625 179.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' VAL . . . . . 0.947 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.1 t -97.89 164.52 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 123.643 0.777 . . . . 0.0 110.512 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.535 ' O ' ' HB ' ' A' ' 16' ' ' ILE . 45.3 t80 -137.49 157.21 47.04 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.693 179.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.14 -167.11 19.38 Favored Glycine 0 C--N 1.337 0.628 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.027 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.72 12.57 69.06 Favored Glycine 0 C--N 1.34 0.775 0 C-N-CA 121.609 -0.329 . . . . 0.0 113.185 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.99 -34.75 12.24 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 122.761 0.425 . . . . 0.0 112.007 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' ARG . . . . . 0.637 ' NE ' ' HA3' ' A' ' 10' ' ' GLY . 87.2 mtt-85 -132.36 150.95 52.05 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.22 0.325 . . . . 0.0 110.513 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -142.98 118.04 10.07 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.414 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.744 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 0.2 OUTLIER -148.42 174.93 11.56 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.228 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -75.97 -51.28 12.74 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.16 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASN . . . . . 0.507 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -53.49 92.28 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.405 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ASN . . . . . 0.968 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 8.5 m120 -157.78 109.22 2.28 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 114.559 -1.201 . . . . 0.0 108.914 177.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PHE . . . . . 0.673 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 0.7 OUTLIER -97.42 -168.53 1.7 Allowed 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -176.655 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.93 -68.58 0.82 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 113.242 -1.799 . . . . 0.0 112.609 178.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' SER . . . . . 0.45 ' HA ' ' CE2' ' A' ' 19' ' ' TYR . 52.6 m -154.43 177.35 11.26 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.268 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.32 -37.32 72.32 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.48 -54.46 46.35 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 123.356 0.41 . . . . 0.0 111.187 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -73.23 -31.73 64.32 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.603 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' CYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 45' ' ' SER . 7.6 t -58.94 -40.8 85.76 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.374 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 74.0 mtm -84.03 -34.21 24.33 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 123.627 0.579 . . . . 0.0 110.533 178.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -54.6 -38.14 66.42 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.705 178.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' THR . . . . . 0.439 ' HB ' ' HZ ' ' A' ' 43' ' ' PHE . 11.5 m -100.37 -48.04 4.71 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.57 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' CYS . . . . . 0.482 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -116.1 55.16 0.81 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -179.145 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.475 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.48 179.277 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.5 p-10 . . . . . 0 N--CA 1.489 1.505 0 CA-C-O 120.55 0.214 . . . . 0.0 111.406 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.48 ' HB2' ' HA ' ' A' ' 41' ' ' ASN . 0.4 OUTLIER -129.7 52.03 2.03 Favored 'General case' 0 C--O 1.239 0.506 0 CA-C-O 121.376 0.608 . . . . 0.0 111.314 179.96 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 51.0 t -128.93 -51.07 1.22 Allowed 'General case' 0 CA--C 1.533 0.295 0 CA-C-N 115.541 -0.754 . . . . 0.0 110.733 179.937 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 4.1 pp -100.58 8.44 43.44 Favored 'General case' 0 CA--C 1.542 0.638 0 O-C-N 123.47 0.481 . . . . 0.0 112.135 -179.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.47 ' HB2' ' OD1' ' A' ' 41' ' ' ASN . 55.3 mm-40 -89.87 141.2 28.01 Favored Pre-proline 0 CA--C 1.536 0.439 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.121 179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.45 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 4.2 Cg_exo -75.7 159.37 38.88 Favored 'Trans proline' 0 C--N 1.369 1.613 0 C-N-CA 123.107 2.538 . . . . 0.0 113.085 -179.491 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.587 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 58.7 Cg_endo -63.1 148.12 93.62 Favored 'Trans proline' 0 C--N 1.37 1.709 0 C-N-CA 123.518 2.812 . . . . 0.0 113.619 -179.802 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 19.3 t80 -107.8 45.9 0.98 Allowed 'General case' 0 CA--C 1.543 0.696 0 CA-C-O 121.39 0.614 . . . . 0.0 110.83 -179.921 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.639 ' HA ' ' HD3' ' A' ' 13' ' ' LYS . 21.8 m -54.17 -48.25 71.11 Favored 'General case' 0 N--CA 1.475 0.817 0 CA-C-N 115.782 -0.645 . . . . 0.0 111.755 -179.608 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 54.66 -150.89 16.19 Favored Glycine 0 CA--C 1.534 1.265 0 CA-C-O 119.291 -0.727 . . . . 0.0 113.22 179.523 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 8.4 Cg_endo -87.84 15.74 2.06 Favored 'Trans proline' 0 C--N 1.366 1.45 0 C-N-CA 122.968 2.446 . . . . 0.0 113.344 179.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -140.87 120.17 13.03 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 122.422 0.289 . . . . 0.0 111.541 -179.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.752 ' HE2' ' HA ' ' A' ' 33' ' ' TYR . 2.1 tptm -179.16 108.28 0.04 OUTLIER 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.969 1.308 . . . . 0.0 108.114 179.453 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.579 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -76.66 -141.82 0.02 OUTLIER 'General case' 0 CA--C 1.547 0.841 0 CA-C-N 115.432 -0.804 . . . . 0.0 112.881 -177.375 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.45 ' CZ ' ' HB1' ' A' ' 14' ' ' ALA . 0.0 OUTLIER -104.45 46.1 0.93 Allowed 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 112.548 0.573 . . . . 0.0 112.548 -178.168 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 19.0 mt -129.0 90.59 1.48 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.481 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 179.742 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 1.058 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.2 mp -76.5 144.67 11.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.855 0 CA-C-O 121.73 0.776 . . . . 0.0 110.58 -179.397 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.751 ' HG2' ' HA ' ' A' ' 44' ' ' LYS . 4.8 ttt180 -134.2 -160.32 1.04 Allowed 'General case' 0 CA--C 1.542 0.664 0 CA-C-N 113.633 -1.621 . . . . 0.0 110.237 -178.278 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -132.78 147.24 52.31 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 112.049 0.389 . . . . 0.0 112.049 -179.277 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.659 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 6.2 p90 -144.97 141.94 29.39 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 108.545 -0.909 . . . . 0.0 108.545 177.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.57 ' CE2' ' HG2' ' A' ' 50' ' ' MET . 17.3 t80 -84.47 120.7 26.61 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.025 0.379 . . . . 0.0 112.025 -179.169 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.515 ' HB2' ' HB3' ' A' ' 25' ' ' ALA . 0.7 OUTLIER -97.0 95.85 8.09 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 108.568 -0.901 . . . . 0.0 108.568 178.362 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -50.88 -14.17 0.19 Allowed 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 114.065 1.135 . . . . 0.0 114.065 -178.197 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -95.91 -26.66 15.51 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 117.536 0.153 . . . . 0.0 111.214 179.602 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.515 ' HB3' ' HB2' ' A' ' 22' ' ' ASN . . . -85.1 -44.84 12.64 Favored 'General case' 0 N--CA 1.465 0.312 0 O-C-N 123.515 0.509 . . . . 0.0 111.689 -179.927 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 112.69 -8.34 25.95 Favored Glycine 0 C--N 1.343 0.923 0 C-N-CA 121.25 -0.5 . . . . 0.0 113.495 179.75 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.515 ' N ' HD13 ' A' ' 27' ' ' LEU . 0.0 OUTLIER -141.56 175.31 9.78 Favored 'General case' 0 C--O 1.238 0.482 0 CA-C-N 116.947 0.374 . . . . 0.0 111.708 -179.608 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.525 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 94.4 m -94.42 102.89 14.87 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.928 -0.578 . . . . 0.0 110.635 179.525 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . . . . . . . . . 53.5 tp60 -79.76 148.36 31.5 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.644 -178.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.458 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 40.7 p -78.41 121.95 25.18 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 113.104 0.779 . . . . 0.0 113.104 -178.076 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.691 ' O ' ' N ' ' A' ' 18' ' ' ARG . 5.5 p90 -138.83 154.03 48.41 Favored 'General case' 0 CA--C 1.536 0.44 0 CA-C-N 114.195 -1.366 . . . . 0.0 108.253 179.191 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 1.058 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 14.3 t -76.94 163.7 3.8 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 CA-C-N 118.508 0.595 . . . . 0.0 112.407 -178.071 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.752 ' HA ' ' HE2' ' A' ' 13' ' ' LYS . 55.3 t80 -117.5 146.54 43.47 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.091 -0.959 . . . . 0.0 109.099 179.138 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -119.12 151.16 17.72 Favored Glycine 0 C--N 1.336 0.543 0 C-N-CA 120.996 -0.621 . . . . 0.0 113.213 -179.395 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.16 -15.01 46.36 Favored Glycine 0 C--N 1.339 0.702 0 O-C-N 123.86 0.388 . . . . 0.0 112.733 179.467 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -87.94 -34.85 17.97 Favored 'General case' 0 N--CA 1.468 0.461 0 C-N-CA 122.704 0.402 . . . . 0.0 111.693 179.692 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -97.34 -72.06 0.66 Allowed 'General case' 0 CA--C 1.536 0.411 0 O-C-N 123.233 0.333 . . . . 0.0 110.443 179.514 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 47.55 117.95 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.409 0 C-N-CA 124.581 1.152 . . . . 0.0 113.888 179.029 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -131.74 -173.17 3.06 Favored 'General case' 0 C--O 1.237 0.417 0 CA-C-N 115.98 -0.555 . . . . 0.0 111.26 179.374 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.0 mtm180 -75.53 -47.81 25.26 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.114 -0.948 . . . . 0.0 112.448 -177.312 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.599 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.2 OUTLIER -69.98 76.57 0.48 Allowed 'General case' 0 N--CA 1.472 0.666 0 CA-C-O 121.217 0.532 . . . . 0.0 111.627 -179.523 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.5 m120 -154.74 128.51 8.69 Favored 'General case' 0 C--O 1.236 0.377 0 CA-C-N 115.648 -0.706 . . . . 0.0 110.095 178.415 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.54 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 56.9 m-85 -129.97 135.21 48.05 Favored 'General case' 0 C--N 1.332 -0.189 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.137 -179.763 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.751 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 3.2 tppp? -80.1 -38.89 30.73 Favored 'General case' 0 CA--C 1.54 0.567 0 O-C-N 123.267 0.354 . . . . 0.0 111.872 -179.325 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.8 m -111.87 138.53 48.35 Favored 'General case' 0 C--O 1.237 0.405 0 O-C-N 123.234 0.334 . . . . 0.0 111.661 -179.417 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.63 -31.62 72.85 Favored 'General case' 0 N--CA 1.473 0.704 0 CA-C-N 115.749 -0.659 . . . . 0.0 111.709 179.398 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 60.4 mp0 -63.56 -56.9 12.34 Favored 'General case' 0 N--CA 1.471 0.586 0 CA-C-N 115.728 -0.669 . . . . 0.0 110.347 179.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.7 m-20 -68.75 -24.13 64.41 Favored 'General case' 0 N--CA 1.473 0.702 0 CA-C-N 116.109 -0.496 . . . . 0.0 111.156 178.79 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.54 ' HA ' ' CD2' ' A' ' 43' ' ' PHE . 43.4 t -66.81 -54.86 18.2 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.659 178.891 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.57 ' HG2' ' CE2' ' A' ' 21' ' ' TYR . 96.7 mtp -73.26 -30.36 63.39 Favored 'General case' 0 CA--C 1.535 0.388 0 C-N-CA 123.091 0.557 . . . . 0.0 112.218 179.78 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 3.6 tmt_? -74.0 -37.68 64.34 Favored 'General case' 0 N--CA 1.473 0.684 0 O-C-N 123.282 0.364 . . . . 0.0 111.693 -179.718 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 20.4 m -85.91 -33.81 21.11 Favored 'General case' 0 N--CA 1.47 0.556 0 O-C-N 123.129 0.268 . . . . 0.0 111.436 -179.723 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.496 ' HB3' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -87.02 -50.11 6.87 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 121.24 -0.184 . . . . 0.0 110.565 179.928 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -98.12 -101.15 2.16 Favored Glycine 0 C--N 1.341 0.856 0 O-C-N 123.443 0.464 . . . . 0.0 112.547 -179.91 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 124.3 -54.88 0.72 Allowed Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.514 -0.374 . . . . 0.0 112.49 -179.97 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.25 0 CA-C-O 118.105 -0.95 . . . . 0.0 112.308 -179.956 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.8 m-20 . . . . . 0 N--CA 1.489 1.487 0 CA-C-O 120.549 0.214 . . . . 0.0 111.119 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 13.4 p90 -104.85 -161.13 0.8 Allowed 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.049 179.899 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.479 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 42.2 t 73.82 -47.26 0.65 Allowed 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.443 1.097 . . . . 0.0 111.826 -179.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -98.78 -12.86 20.5 Favored 'General case' 0 C--O 1.236 0.376 0 O-C-N 123.188 0.305 . . . . 0.0 111.571 179.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.414 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 5.8 mm-40 -97.85 147.9 33.71 Favored Pre-proline 0 CA--C 1.537 0.446 0 O-C-N 123.258 0.349 . . . . 0.0 111.04 -179.995 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.414 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 3.7 Cg_exo -78.04 165.13 26.54 Favored 'Trans proline' 0 C--N 1.369 1.631 0 C-N-CA 123.264 2.643 . . . . 0.0 112.949 -179.697 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.565 ' HD3' ' CD1' ' A' ' 20' ' ' PHE . 50.0 Cg_endo -60.48 161.1 21.58 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 123.492 2.795 . . . . 0.0 113.085 179.862 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.447 ' CE2' ' HD2' ' A' ' 37' ' ' ARG . 10.3 t80 -125.83 36.27 4.56 Favored 'General case' 0 CA--C 1.544 0.747 0 N-CA-C 112.374 0.509 . . . . 0.0 112.374 -179.474 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.45 ' OG1' ' HD2' ' A' ' 31' ' ' PHE . 11.8 m -62.04 -47.79 83.16 Favored 'General case' 0 N--CA 1.475 0.805 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 178.688 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 74.37 -161.03 53.51 Favored Glycine 0 CA--C 1.532 1.153 0 CA-C-N 115.351 -0.84 . . . . 0.0 112.704 179.514 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_endo -83.46 42.1 1.19 Allowed 'Trans proline' 0 C--N 1.367 1.52 0 C-N-CA 123.067 2.511 . . . . 0.0 112.572 179.584 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 33.4 m -92.35 -66.12 0.95 Allowed 'General case' 0 N--CA 1.466 0.366 0 CA-C-N 115.922 -0.581 . . . . 0.0 111.466 -179.508 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? 66.03 98.18 0.05 OUTLIER 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 124.016 0.927 . . . . 0.0 111.571 -179.655 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.544 ' HB1' HH21 ' A' ' 15' ' ' ARG . . . -119.03 -175.05 2.83 Favored 'General case' 0 CA--C 1.537 0.47 0 CA-C-N 115.211 -0.904 . . . . 0.0 110.535 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.895 ' HE ' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -109.0 38.24 2.34 Favored 'General case' 0 CA--C 1.545 0.753 0 CA-C-O 121.163 0.506 . . . . 0.0 111.866 179.844 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.419 ' C ' HG13 ' A' ' 32' ' ' VAL . 16.2 mt -138.52 71.41 0.27 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.784 -0.644 . . . . 0.0 109.384 179.44 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 1.062 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 13.1 tt -75.06 117.32 19.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.869 0 CA-C-O 122.403 1.097 . . . . 0.0 111.48 -179.784 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.761 ' N ' ' O ' ' A' ' 31' ' ' PHE . 54.4 mtt180 -100.28 -159.22 0.72 Allowed 'General case' 0 C--N 1.316 -0.852 0 CA-C-N 112.668 -2.06 . . . . 0.0 109.818 179.56 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.452 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 10.2 m-85 -125.5 164.23 20.95 Favored 'General case' 0 N--CA 1.468 0.457 0 N-CA-C 112.194 0.442 . . . . 0.0 112.194 -179.349 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.736 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 7.1 p90 -158.13 164.31 36.74 Favored 'General case' 0 N--CA 1.474 0.775 0 CA-C-N 114.894 -1.048 . . . . 0.0 108.994 176.915 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.632 ' HD1' ' SG ' ' A' ' 28' ' ' CYS . 63.1 t80 -108.9 110.28 21.56 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 112.42 0.526 . . . . 0.0 112.42 -179.852 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.641 HD21 ' HB2' ' A' ' 29' ' ' GLN . 0.2 OUTLIER -77.53 83.48 3.93 Favored 'General case' 0 C--O 1.239 0.548 0 CA-C-O 121.489 0.661 . . . . 0.0 109.916 -179.418 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.479 ' HB2' ' O ' ' A' ' 3' ' ' CYS . . . -62.31 -2.62 1.05 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-N 115.2 -0.909 . . . . 0.0 112.213 -179.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 50.5 mtpt -96.95 -38.07 9.95 Favored 'General case' 0 C--N 1.346 0.452 0 C-N-CA 122.359 0.263 . . . . 0.0 110.763 179.517 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -87.04 -56.01 3.57 Favored 'General case' 0 C--O 1.234 0.285 0 CA-C-N 115.675 -0.693 . . . . 0.0 111.016 179.889 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 153.56 -55.81 0.43 Allowed Glycine 0 C--N 1.343 0.929 0 C-N-CA 121.295 -0.478 . . . . 0.0 112.453 179.891 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 pp -96.74 -175.16 3.21 Favored 'General case' 0 CA--C 1.545 0.772 0 N-CA-C 112.926 0.713 . . . . 0.0 112.926 -178.337 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.632 ' SG ' ' HD1' ' A' ' 21' ' ' TYR . 89.1 m -98.67 139.62 34.1 Favored 'General case' 0 C--N 1.344 0.337 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.271 179.748 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.641 ' HB2' HD21 ' A' ' 22' ' ' ASN . 0.1 OUTLIER -123.38 153.64 40.09 Favored 'General case' 0 C--O 1.238 0.474 0 O-C-N 123.263 0.352 . . . . 0.0 110.625 -179.713 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.674 ' HB ' HG12 ' A' ' 17' ' ' ILE . 40.4 p -85.36 120.0 26.35 Favored 'General case' 0 CA--C 1.536 0.44 0 N-CA-C 114.204 1.187 . . . . 0.0 114.204 -177.403 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.761 ' O ' ' N ' ' A' ' 18' ' ' ARG . 4.1 p90 -108.77 163.3 13.39 Favored 'General case' 0 N--CA 1.469 0.481 0 CA-C-N 114.263 -1.335 . . . . 0.0 107.421 177.284 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 1.062 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 41.0 t -104.39 144.25 14.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.35 0 CA-C-N 119.546 1.066 . . . . 0.0 109.71 179.409 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.578 ' HB2' ' HD2' ' A' ' 18' ' ' ARG . 39.0 t80 -115.07 124.66 52.15 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.807 -0.633 . . . . 0.0 110.007 179.45 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -125.45 -168.29 12.69 Favored Glycine 0 C--N 1.335 0.484 0 CA-C-N 115.912 -0.585 . . . . 0.0 112.581 -179.954 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -97.28 23.9 33.79 Favored Glycine 0 C--N 1.336 0.564 0 C-N-CA 121.353 -0.451 . . . . 0.0 112.936 179.939 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 21.6 p -95.5 -44.05 7.69 Favored 'General case' 0 CA--C 1.534 0.356 0 C-N-CA 122.281 0.233 . . . . 0.0 111.055 179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.447 ' HD2' ' CE2' ' A' ' 8' ' ' TYR . 40.2 mmt180 -133.4 169.68 16.59 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.006 -0.543 . . . . 0.0 110.897 -179.775 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -158.66 120.96 3.6 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.031 0.532 . . . . 0.0 110.084 179.434 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.4 mmtp -141.65 -169.1 2.82 Favored 'General case' 0 N--CA 1.466 0.369 0 CA-C-O 121.326 0.584 . . . . 0.0 112.082 -179.371 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 24.8 mmm180 -76.23 -67.61 0.67 Allowed 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 114.459 -1.246 . . . . 0.0 111.93 -177.996 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.449 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.4 OUTLIER -44.9 99.6 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.926 0 N-CA-C 113.148 0.795 . . . . 0.0 113.148 -178.448 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.52 ' ND2' HH11 ' A' ' 18' ' ' ARG . 7.5 m120 -151.37 139.28 19.95 Favored 'General case' 0 C--O 1.236 0.342 0 CA-C-N 114.527 -1.215 . . . . 0.0 109.947 178.552 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.736 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 97.7 m-85 -142.71 147.71 36.09 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.69 -0.686 . . . . 0.0 112.588 -179.957 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -96.71 -44.04 7.28 Favored 'General case' 0 N--CA 1.468 0.445 0 CA-C-N 115.172 -0.922 . . . . 0.0 112.643 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.4 m -133.9 165.07 25.85 Favored 'General case' 0 N--CA 1.472 0.652 0 N-CA-C 111.894 0.331 . . . . 0.0 111.894 -178.676 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.432 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -62.36 -69.58 0.25 Allowed 'General case' 0 N--CA 1.474 0.74 0 CA-C-N 115.982 -0.554 . . . . 0.0 112.052 -179.925 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.482 ' O ' ' HG2' ' A' ' 51' ' ' ARG . 67.7 tt0 -51.52 -37.01 47.27 Favored 'General case' 0 N--CA 1.479 0.999 0 C-N-CA 122.813 0.445 . . . . 0.0 111.283 179.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.409 ' HA ' ' HG2' ' A' ' 51' ' ' ARG . 1.4 m-20 -69.0 -34.0 74.56 Favored 'General case' 0 N--CA 1.47 0.536 0 CA-C-N 115.699 -0.682 . . . . 0.0 110.462 178.247 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.662 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 33.8 t -65.93 -46.19 79.15 Favored 'General case' 0 N--CA 1.468 0.473 0 CA-C-N 115.741 -0.663 . . . . 0.0 111.005 178.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.448 ' SD ' ' SG ' ' A' ' 28' ' ' CYS . 1.4 mpt? -64.75 -52.29 57.77 Favored 'General case' 0 CA--C 1.538 0.503 0 CA-C-N 116.176 -0.466 . . . . 0.0 111.931 179.259 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.482 ' HG2' ' O ' ' A' ' 47' ' ' GLU . 46.0 ptt85 -64.34 -37.16 86.53 Favored 'General case' 0 N--CA 1.477 0.911 0 N-CA-C 113.466 0.913 . . . . 0.0 113.466 -178.853 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 25.5 m -80.38 -31.52 37.76 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 111.931 0.345 . . . . 0.0 111.931 -179.298 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.588 ' SG ' ' CD2' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -88.41 -63.18 1.34 Allowed 'General case' 0 CA--C 1.539 0.547 0 CA-C-O 119.454 -0.307 . . . . 0.0 111.502 -179.616 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.455 ' N ' ' SG ' ' A' ' 53' ' ' CYS . . . -137.15 70.65 0.49 Allowed Glycine 0 C--N 1.347 1.148 0 C-N-CA 120.797 -0.716 . . . . 0.0 112.553 -179.99 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -117.23 60.71 0.44 Allowed Glycine 0 C--N 1.337 0.62 0 C-N-CA 121.478 -0.391 . . . . 0.0 112.535 -179.977 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.082 0 CA-C-O 118.211 -0.899 . . . . 0.0 111.069 -179.918 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 N--CA 1.488 1.474 0 CA-C-O 120.476 0.179 . . . . 0.0 111.072 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.6 p90 -96.14 7.74 45.62 Favored 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.833 -0.621 . . . . 0.0 112.028 -179.979 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.535 ' O ' ' HB2' ' A' ' 23' ' ' ALA . 46.9 t -84.05 -24.0 30.61 Favored 'General case' 0 N--CA 1.469 0.516 0 CA-C-N 116.353 -0.385 . . . . 0.0 111.008 179.267 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.493 ' HA ' ' CB ' ' A' ' 23' ' ' ALA . 4.1 mm? -116.86 -12.53 10.75 Favored 'General case' 0 N--CA 1.467 0.383 0 O-C-N 123.651 0.594 . . . . 0.0 111.471 179.55 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.412 ' HA ' ' HD3' ' A' ' 6' ' ' PRO . 5.8 mm-40 -96.52 144.37 27.73 Favored Pre-proline 0 N--CA 1.468 0.43 0 O-C-N 123.287 0.367 . . . . 0.0 111.154 179.931 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.412 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 4.9 Cg_exo -78.7 163.18 26.67 Favored 'Trans proline' 0 C--N 1.369 1.642 0 C-N-CA 123.293 2.662 . . . . 0.0 113.052 -179.49 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.513 ' HD3' ' CE1' ' A' ' 20' ' ' PHE . 62.6 Cg_endo -64.25 168.84 11.83 Favored 'Trans proline' 0 C--N 1.374 1.902 0 C-N-CA 123.498 2.798 . . . . 0.0 113.084 179.91 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.537 ' CZ ' ' HD3' ' A' ' 37' ' ' ARG . 7.2 t80 -129.27 1.16 5.15 Favored 'General case' 0 CA--C 1.547 0.831 0 N-CA-C 113.045 0.757 . . . . 0.0 113.045 -179.482 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 7.3 m -44.22 -13.05 0.02 OUTLIER 'General case' 0 N--CA 1.495 1.789 0 N-CA-C 113.442 0.904 . . . . 0.0 113.442 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.405 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 49.46 -146.21 7.27 Favored Glycine 0 CA--C 1.535 1.327 0 N-CA-C 114.657 0.623 . . . . 0.0 114.657 177.67 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.5 Cg_endo -83.43 4.72 6.84 Favored 'Trans proline' 0 C--N 1.37 1.698 0 C-N-CA 123.405 2.737 . . . . 0.0 113.487 179.918 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -84.4 136.61 33.79 Favored 'General case' 0 N--CA 1.468 0.445 0 N-CA-C 112.701 0.63 . . . . 0.0 112.701 179.851 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -132.1 82.74 2.04 Favored 'General case' 0 C--O 1.239 0.516 0 CA-C-N 114.867 -1.06 . . . . 0.0 109.798 -179.818 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.6 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -78.57 -161.16 0.26 Allowed 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 114.367 -1.288 . . . . 0.0 111.094 -179.684 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.759 ' HE ' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -120.84 39.37 3.8 Favored 'General case' 0 CA--C 1.542 0.667 0 CA-C-O 121.188 0.518 . . . . 0.0 111.358 179.782 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.551 ' HB ' ' O ' ' A' ' 33' ' ' TYR . 24.5 mt -134.97 75.66 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.545 0.769 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.061 179.812 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 1.08 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 21.2 mm -55.83 144.78 6.89 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.268 0 C-N-CA 123.692 0.797 . . . . 0.0 110.837 179.942 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.53 HH12 ' HE3' ' A' ' 44' ' ' LYS . 14.4 mmt180 -149.11 171.63 16.1 Favored 'General case' 0 C--N 1.326 -0.451 0 CA-C-N 113.679 -1.601 . . . . 0.0 110.166 -177.809 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.469 ' C ' ' HB2' ' A' ' 43' ' ' PHE . 4.3 m-85 -117.63 155.76 29.32 Favored 'General case' 0 C--O 1.237 0.442 0 C-N-CA 121.261 -0.176 . . . . 0.0 111.237 179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.805 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 1.0 OUTLIER -146.68 152.86 39.55 Favored 'General case' 0 N--CA 1.471 0.597 0 O-C-N 123.643 0.589 . . . . 0.0 110.112 178.797 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.509 ' HB2' ' SG ' ' A' ' 49' ' ' CYS . 30.3 t80 -100.43 132.94 45.54 Favored 'General case' 0 C--O 1.236 0.351 0 CA-C-N 116.514 -0.312 . . . . 0.0 110.586 179.8 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.5 m120 -95.31 127.11 41.09 Favored 'General case' 0 C--O 1.239 0.548 0 N-CA-C 109.128 -0.694 . . . . 0.0 109.128 178.271 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.535 ' HB2' ' O ' ' A' ' 3' ' ' CYS . . . -94.59 14.15 21.87 Favored 'General case' 0 C--O 1.238 0.462 0 CA-C-N 116.206 -0.452 . . . . 0.0 111.603 179.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.8 tttt -97.03 -23.1 16.43 Favored 'General case' 0 C--O 1.234 0.273 0 N-CA-C 109.663 -0.495 . . . . 0.0 109.663 178.714 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.463 ' HB3' ' HG ' ' A' ' 27' ' ' LEU . . . -136.77 -23.25 1.2 Allowed 'General case' 0 C--O 1.235 0.303 0 CA-C-N 115.305 -0.861 . . . . 0.0 112.264 -179.27 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 97.69 -7.79 63.45 Favored Glycine 0 C--N 1.346 1.106 0 C-N-CA 121.049 -0.596 . . . . 0.0 112.106 -178.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.463 ' HG ' ' HB3' ' A' ' 25' ' ' ALA . 3.4 pp -87.31 144.8 26.62 Favored 'General case' 0 C--O 1.236 0.348 0 C-N-CA 122.757 0.423 . . . . 0.0 111.759 -179.583 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.479 ' H ' ' HE1' ' A' ' 50' ' ' MET . 78.3 m -92.19 142.3 27.64 Favored 'General case' 0 C--O 1.235 0.319 0 CA-C-N 115.67 -0.695 . . . . 0.0 109.832 179.315 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.538 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 2.5 tm0? -124.22 145.58 49.26 Favored 'General case' 0 C--O 1.238 0.499 0 CA-C-O 121.185 0.516 . . . . 0.0 111.835 -178.056 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.413 HG22 ' CZ ' ' A' ' 19' ' ' TYR . 39.8 p -85.4 143.11 28.81 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 114.509 -1.223 . . . . 0.0 111.826 -179.347 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.559 ' CZ ' ' HB3' ' A' ' 20' ' ' PHE . 0.0 OUTLIER -165.13 176.13 8.76 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 115.858 -0.61 . . . . 0.0 109.9 178.343 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 1.08 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 1.3 t -92.77 -162.07 0.09 OUTLIER 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 124.32 1.048 . . . . 0.0 111.141 -178.791 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.749 ' H ' HG12 ' A' ' 32' ' ' VAL . 65.4 t80 -174.33 144.15 0.91 Allowed 'General case' 0 N--CA 1.469 0.494 0 C-N-CA 124.631 1.173 . . . . 0.0 109.037 178.808 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -151.89 -160.55 9.59 Favored Glycine 0 C--N 1.337 0.602 0 C-N-CA 120.962 -0.637 . . . . 0.0 113.225 -179.722 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -94.77 15.05 64.18 Favored Glycine 0 C--N 1.338 0.693 0 O-C-N 123.781 0.342 . . . . 0.0 113.406 -179.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -90.0 -48.03 7.47 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 112.509 0.559 . . . . 0.0 112.509 179.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.537 ' HD3' ' CZ ' ' A' ' 8' ' ' TYR . 2.6 mmp_? -135.49 119.54 17.55 Favored 'General case' 0 N--CA 1.469 0.495 0 CA-C-O 121.021 0.439 . . . . 0.0 111.498 179.685 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -118.46 119.38 34.4 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.239 -0.891 . . . . 0.0 109.635 179.242 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.405 ' HB3' ' H ' ' A' ' 40' ' ' ARG . 9.8 tmtt? -124.43 -114.87 0.29 Allowed 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 116.533 -0.303 . . . . 0.0 110.824 -178.746 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.405 ' H ' ' HB3' ' A' ' 39' ' ' LYS . 24.4 mmm180 -142.39 -33.37 0.48 Allowed 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 122.657 0.383 . . . . 0.0 111.306 -179.852 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.492 ' ND2' ' HB2' ' A' ' 20' ' ' PHE . 0.4 OUTLIER -66.62 101.38 0.78 Allowed 'General case' 0 C--O 1.236 0.393 0 CA-C-O 121.696 0.76 . . . . 0.0 111.45 -179.223 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 7.2 m120 -146.38 150.57 35.93 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 114.343 -1.299 . . . . 0.0 109.61 179.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.805 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 64.6 m-85 -153.36 165.35 36.05 Favored 'General case' 0 C--O 1.237 0.422 0 CA-C-N 116.032 -0.531 . . . . 0.0 110.811 179.026 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.53 ' HE3' HH12 ' A' ' 18' ' ' ARG . 13.8 mptt -99.02 -54.82 2.88 Favored 'General case' 0 N--CA 1.465 0.275 0 CA-C-N 115.896 -0.593 . . . . 0.0 111.701 179.676 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.6 m -143.71 170.6 15.56 Favored 'General case' 0 N--CA 1.47 0.555 0 CA-C-N 116.079 -0.51 . . . . 0.0 110.724 -179.431 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.87 -46.79 87.9 Favored 'General case' 0 N--CA 1.474 0.775 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.0 tp10 -52.17 -60.57 3.05 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.069 0.548 . . . . 0.0 110.941 -179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.43 ' O ' ' N ' ' A' ' 52' ' ' THR . 49.0 m-20 -59.55 -53.44 58.11 Favored 'General case' 0 C--N 1.349 0.545 0 CA-C-N 116.629 -0.26 . . . . 0.0 110.316 178.996 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.632 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 28.5 t -40.28 -48.25 2.6 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.546 0.738 . . . . 0.0 111.961 179.217 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.479 ' HE1' ' H ' ' A' ' 28' ' ' CYS . 25.6 mmt -67.59 -47.11 70.68 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-N 115.875 -0.602 . . . . 0.0 111.854 179.412 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 20.6 tpt180 -79.3 -9.55 59.61 Favored 'General case' 0 CA--C 1.545 0.783 0 N-CA-C 112.62 0.6 . . . . 0.0 112.62 -179.468 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.43 ' N ' ' O ' ' A' ' 48' ' ' ASP . 40.2 m -91.67 -45.38 8.49 Favored 'General case' 0 N--CA 1.466 0.364 0 C-N-CA 122.264 0.225 . . . . 0.0 110.586 179.877 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.64 -43.72 8.16 Favored 'General case' 0 CA--C 1.536 0.422 0 O-C-N 123.159 0.287 . . . . 0.0 110.802 -179.998 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -95.78 -100.81 1.86 Allowed Glycine 0 C--N 1.345 1.043 0 C-N-CA 121.195 -0.526 . . . . 0.0 112.716 179.968 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 147.42 55.28 0.02 OUTLIER Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.436 -0.412 . . . . 0.0 112.515 179.938 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.975 0 CA-C-O 118.203 -0.903 . . . . 0.0 111.086 -179.984 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.6 m-20 . . . . . 0 N--CA 1.489 1.49 0 CA-C-O 120.55 0.214 . . . . 0.0 111.059 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.2 p90 -124.91 -167.22 1.64 Allowed 'General case' 0 CA--C 1.54 0.584 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.17 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.561 ' SG ' ' HB3' ' A' ' 21' ' ' TYR . 6.6 t 72.1 -36.24 0.35 Allowed 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.728 1.211 . . . . 0.0 112.552 179.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.496 ' CD1' ' HB2' ' A' ' 23' ' ' ALA . 13.7 tp -80.05 -10.4 59.77 Favored 'General case' 0 CA--C 1.538 0.503 0 O-C-N 123.419 0.45 . . . . 0.0 111.844 -179.37 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 51.6 mt-10 -95.75 152.59 39.18 Favored Pre-proline 0 CA--C 1.536 0.435 0 O-C-N 123.395 0.435 . . . . 0.0 110.374 179.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_endo -61.92 149.46 90.13 Favored 'Trans proline' 0 C--N 1.368 1.602 0 C-N-CA 122.603 2.202 . . . . 0.0 113.166 -179.633 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.466 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 31.1 Cg_endo -55.71 138.21 80.57 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 123.648 2.899 . . . . 0.0 113.476 -179.967 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.571 ' O ' ' N ' ' A' ' 10' ' ' GLY . 1.6 t80 -91.18 8.11 37.36 Favored 'General case' 0 CA--C 1.546 0.819 0 O-C-N 123.568 0.543 . . . . 0.0 111.861 -179.242 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.544 HG23 ' O ' ' A' ' 32' ' ' VAL . 10.6 m -30.04 -18.99 0.0 OUTLIER 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 115.334 1.605 . . . . 0.0 115.334 -178.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.571 ' N ' ' O ' ' A' ' 8' ' ' TYR . . . 5.86 110.91 0.0 OUTLIER Glycine 0 C--N 1.358 1.762 0 CA-C-O 118.41 -1.217 . . . . 0.0 114.488 178.912 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -23.06 87.1 0.0 OUTLIER 'Trans proline' 0 C--N 1.378 2.081 0 C-N-CA 124.953 3.769 . . . . 0.0 115.559 -178.945 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 76.9 m -129.9 -157.49 0.82 Allowed 'General case' 0 CA--C 1.54 0.573 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.283 -179.463 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 32.5 mmtp -98.6 71.61 1.98 Allowed 'General case' 0 C--O 1.239 0.543 0 CA-C-O 122.209 1.004 . . . . 0.0 108.318 178.753 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.664 ' HB1' HG12 ' A' ' 32' ' ' VAL . . . -100.16 128.02 46.31 Favored 'General case' 0 C--N 1.324 -0.509 0 CA-C-N 113.688 -1.596 . . . . 0.0 111.82 -179.166 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -140.74 20.78 2.34 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 115.557 -0.747 . . . . 0.0 110.832 179.199 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 32.2 mt -137.21 105.1 3.7 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 CA-C-N 114.753 -1.112 . . . . 0.0 109.877 -179.491 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.909 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 9.1 tt -81.44 134.72 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.735 0 CA-C-O 121.545 0.688 . . . . 0.0 110.26 179.622 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.814 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 57.7 mtt180 -128.44 -176.92 3.97 Favored 'General case' 0 C--N 1.322 -0.603 0 CA-C-N 113.864 -1.516 . . . . 0.0 111.105 -177.597 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.551 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 1.8 m-85 -122.83 148.55 45.26 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 112.562 0.578 . . . . 0.0 112.562 -178.299 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.466 ' CE2' ' HD3' ' A' ' 7' ' ' PRO . 8.9 p90 -144.3 150.6 38.12 Favored 'General case' 0 CA--C 1.541 0.611 0 CA-C-N 114.674 -1.148 . . . . 0.0 109.357 178.71 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.652 ' HE1' ' HA2' ' A' ' 26' ' ' GLY . 3.7 t80 -86.56 125.3 33.69 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 -179.976 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.1 m120 -97.4 121.94 39.87 Favored 'General case' 0 N--CA 1.449 -0.495 0 N-CA-C 107.381 -1.34 . . . . 0.0 107.381 176.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.496 ' HB2' ' CD1' ' A' ' 4' ' ' LEU . . . -80.36 5.26 15.39 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 111.869 0.322 . . . . 0.0 111.869 -179.195 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -96.55 -16.57 21.0 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 116.33 -0.395 . . . . 0.0 110.873 179.065 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -128.09 -39.36 1.74 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 115.832 -0.622 . . . . 0.0 112.106 -179.368 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.652 ' HA2' ' HE1' ' A' ' 21' ' ' TYR . . . 114.12 -42.4 1.94 Allowed Glycine 0 C--N 1.343 0.934 0 C-N-CA 121.416 -0.421 . . . . 0.0 112.317 -179.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.737 HD23 ' H ' ' A' ' 27' ' ' LEU . 0.8 OUTLIER -77.1 169.6 18.04 Favored 'General case' 0 C--O 1.243 0.754 0 N-CA-C 112.553 0.575 . . . . 0.0 112.553 -179.127 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 62.7 m -96.05 136.14 36.9 Favored 'General case' 0 C--N 1.343 0.297 0 CA-C-N 115.057 -0.974 . . . . 0.0 110.167 179.691 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.551 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 38.1 mt-30 -106.15 156.17 18.71 Favored 'General case' 0 C--O 1.236 0.392 0 O-C-N 123.746 0.654 . . . . 0.0 111.652 -179.969 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.523 HG22 ' CE1' ' A' ' 19' ' ' TYR . 47.8 p -92.26 129.44 38.21 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-N 115.449 -0.796 . . . . 0.0 111.398 -179.552 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.474 ' C ' HG13 ' A' ' 17' ' ' ILE . 3.1 p90 -142.83 138.76 30.56 Favored 'General case' 0 CA--C 1.537 0.455 0 CA-C-N 115.423 -0.808 . . . . 0.0 108.968 179.734 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.909 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 26.0 t -88.7 103.79 14.18 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.5 0 C-N-CA 122.889 0.475 . . . . 0.0 111.74 -178.522 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 41.0 t80 -68.08 146.19 53.71 Favored 'General case' 0 CA--C 1.536 0.422 0 CA-C-N 115.426 -0.807 . . . . 0.0 111.367 179.304 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -120.31 153.24 16.76 Favored Glycine 0 C--N 1.336 0.556 0 CA-C-N 115.576 -0.738 . . . . 0.0 112.01 179.574 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -98.79 44.64 1.7 Allowed Glycine 0 C--N 1.336 0.575 0 C-N-CA 121.254 -0.498 . . . . 0.0 113.103 -179.626 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 28.5 p -95.7 -36.18 11.29 Favored 'General case' 0 N--CA 1.466 0.346 0 N-CA-C 111.63 0.233 . . . . 0.0 111.63 179.729 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.434 ' O ' ' HB3' ' A' ' 38' ' ' ALA . 88.4 mtt-85 -128.17 -67.57 0.8 Allowed 'General case' 0 CA--C 1.536 0.404 0 O-C-N 123.311 0.382 . . . . 0.0 111.394 -179.946 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.434 ' HB3' ' O ' ' A' ' 37' ' ' ARG . . . 96.36 132.91 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.517 0 C-N-CA 125.093 1.357 . . . . 0.0 110.056 -178.659 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 14.5 tppt? -129.16 -112.17 0.27 Allowed 'General case' 0 CA--C 1.548 0.897 0 O-C-N 123.563 0.539 . . . . 0.0 111.772 -178.406 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 89.3 mtm180 -151.67 -35.42 0.13 Allowed 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 112.598 0.592 . . . . 0.0 112.598 -179.458 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.497 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.3 OUTLIER -76.96 94.71 4.0 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 112.275 0.472 . . . . 0.0 112.275 -178.087 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.814 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 9.7 m120 -157.86 125.01 5.05 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 115.555 -0.748 . . . . 0.0 111.501 178.109 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.546 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 82.1 m-85 -132.51 101.54 5.36 Favored 'General case' 0 CA--C 1.531 0.243 0 CA-C-N 116.09 -0.505 . . . . 0.0 110.803 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.3 tptp -65.51 -13.29 58.57 Favored 'General case' 0 N--CA 1.477 0.886 0 N-CA-C 112.791 0.663 . . . . 0.0 112.791 -179.023 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.3 m -131.07 140.3 50.02 Favored 'General case' 0 C--O 1.237 0.406 0 CA-C-O 120.638 0.256 . . . . 0.0 111.271 -179.995 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.74 -48.0 76.2 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 115.932 -0.576 . . . . 0.0 111.13 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.6 tt0 -47.72 -59.16 3.5 Favored 'General case' 0 N--CA 1.477 0.877 0 O-C-N 124.008 0.818 . . . . 0.0 110.281 179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.6 m-20 -63.68 -36.74 84.86 Favored 'General case' 0 N--CA 1.472 0.668 0 C-N-CA 122.625 0.37 . . . . 0.0 111.18 178.687 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.705 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 51.0 t -56.41 -60.48 3.46 Favored 'General case' 0 N--CA 1.475 0.82 0 O-C-N 123.594 0.558 . . . . 0.0 110.758 179.361 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 66.0 mtt -63.56 -36.89 85.3 Favored 'General case' 0 CA--C 1.536 0.421 0 N-CA-C 112.378 0.51 . . . . 0.0 112.378 179.229 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 42.5 ttt85 -67.39 -38.46 84.74 Favored 'General case' 0 N--CA 1.474 0.771 0 N-CA-C 113.008 0.744 . . . . 0.0 113.008 -179.202 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 16.9 m -79.07 -49.72 12.21 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 122.879 0.112 . . . . 0.0 111.084 -179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.705 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -80.92 -58.59 3.02 Favored 'General case' 0 CA--C 1.538 0.509 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 179.653 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -86.92 45.44 3.43 Favored Glycine 0 C--N 1.346 1.107 0 C-N-CA 120.906 -0.664 . . . . 0.0 113.23 -179.598 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -132.2 -69.3 0.09 OUTLIER Glycine 0 C--N 1.337 0.624 0 C-N-CA 121.487 -0.387 . . . . 0.0 112.508 179.962 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.079 0 CA-C-O 118.23 -0.89 . . . . 0.0 111.129 179.997 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.45 0 CA-C-O 120.503 0.192 . . . . 0.0 111.099 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.5 p90 -123.64 -148.44 0.4 Allowed 'General case' 0 CA--C 1.544 0.732 0 CA-C-N 115.908 -0.587 . . . . 0.0 110.197 -179.963 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.494 ' SG ' ' HB3' ' A' ' 21' ' ' TYR . 34.0 t 70.45 -14.06 0.43 Allowed 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 124.299 1.039 . . . . 0.0 112.638 -179.847 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.499 HD13 ' CE2' ' A' ' 21' ' ' TYR . 19.1 tp -92.93 42.7 1.11 Allowed 'General case' 0 C--O 1.239 0.544 0 CA-C-O 121.533 0.682 . . . . 0.0 111.088 -179.264 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.45 ' HB3' ' NZ ' ' A' ' 39' ' ' LYS . 61.1 mp0 -129.98 144.92 55.03 Favored Pre-proline 0 CA--C 1.534 0.358 0 CA-C-N 115.051 -0.977 . . . . 0.0 109.966 179.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 11.9 Cg_exo -71.45 153.88 60.68 Favored 'Trans proline' 0 C--N 1.367 1.551 0 C-N-CA 122.887 2.391 . . . . 0.0 112.804 -179.65 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.442 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 36.4 Cg_endo -57.83 133.7 57.82 Favored 'Trans proline' 0 C--N 1.372 1.782 0 C-N-CA 123.458 2.772 . . . . 0.0 113.265 179.985 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.0 t80 -105.17 13.27 30.92 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.917 -0.583 . . . . 0.0 112.01 -179.17 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.522 HG22 ' O ' ' A' ' 12' ' ' CYS . 7.1 m -46.01 -24.15 0.39 Allowed 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.412 0.685 . . . . 0.0 112.702 -179.99 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 53.47 -141.53 30.98 Favored Glycine 0 CA--C 1.534 1.251 0 CA-C-O 119.482 -0.621 . . . . 0.0 114.351 178.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.489 ' HD2' ' HE ' ' A' ' 37' ' ' ARG . 6.3 Cg_exo -79.25 -4.48 13.79 Favored 'Trans proline' 0 C--N 1.369 1.657 0 C-N-CA 123.296 2.664 . . . . 0.0 113.218 179.879 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.522 ' O ' HG22 ' A' ' 9' ' ' THR . 0.1 OUTLIER -86.01 141.27 29.61 Favored 'General case' 0 C--N 1.343 0.311 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 179.712 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -135.01 85.93 2.21 Favored 'General case' 0 C--O 1.238 0.494 0 CA-C-N 115.18 -0.918 . . . . 0.0 109.647 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.433 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -78.01 -167.51 1.03 Allowed 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 114.569 -1.196 . . . . 0.0 111.498 -179.288 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.755 ' HD3' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -119.43 34.34 5.26 Favored 'General case' 0 CA--C 1.541 0.609 0 CA-C-O 121.178 0.513 . . . . 0.0 111.45 -179.073 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 26.3 mt -132.29 78.36 0.52 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.637 0 CA-C-N 115.749 -0.659 . . . . 0.0 110.44 -179.75 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 1.045 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.0 mp -65.28 145.9 13.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.955 0 CA-C-O 121.454 0.645 . . . . 0.0 109.669 179.526 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.711 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 65.4 mtt180 -148.19 168.81 21.51 Favored 'General case' 0 C--N 1.326 -0.44 0 CA-C-N 114.234 -1.348 . . . . 0.0 110.726 -177.327 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.534 ' CE1' HG22 ' A' ' 30' ' ' THR . 1.6 m-85 -112.85 148.4 34.98 Favored 'General case' 0 C--O 1.241 0.631 0 N-CA-C 111.856 0.317 . . . . 0.0 111.856 -179.005 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.596 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 4.8 p90 -141.49 152.77 44.47 Favored 'General case' 0 CA--C 1.54 0.589 0 O-C-N 124.449 1.093 . . . . 0.0 109.435 179.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.551 ' HE1' ' HA2' ' A' ' 26' ' ' GLY . 7.5 t80 -83.68 144.45 29.38 Favored 'General case' 0 N--CA 1.475 0.795 0 N-CA-C 112.136 0.421 . . . . 0.0 112.136 -179.796 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 56.1 m-80 -123.07 122.38 38.33 Favored 'General case' 0 N--CA 1.446 -0.627 0 N-CA-C 107.955 -1.128 . . . . 0.0 107.955 175.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.474 ' HB2' HD11 ' A' ' 4' ' ' LEU . . . -79.75 10.57 3.94 Favored 'General case' 0 CA--C 1.538 0.509 0 CA-C-N 116.633 -0.258 . . . . 0.0 111.686 -179.667 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 33.4 ttmt -96.56 -22.25 17.18 Favored 'General case' 0 C--N 1.346 0.444 0 N-CA-C 110.189 -0.301 . . . . 0.0 110.189 179.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.52 ' O ' HD23 ' A' ' 27' ' ' LEU . . . -133.0 -11.6 2.93 Favored 'General case' 0 CA--C 1.535 0.4 0 CA-C-N 115.585 -0.734 . . . . 0.0 112.075 -179.162 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.551 ' HA2' ' HE1' ' A' ' 21' ' ' TYR . . . 86.8 -39.63 3.09 Favored Glycine 0 C--N 1.345 1.047 0 C-N-CA 121.555 -0.355 . . . . 0.0 113.291 179.737 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.604 HD23 ' H ' ' A' ' 27' ' ' LEU . 0.4 OUTLIER -76.51 178.25 6.78 Favored 'General case' 0 C--O 1.244 0.8 0 N-CA-C 112.335 0.494 . . . . 0.0 112.335 -179.233 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 89.3 m -102.27 151.01 22.73 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-N 115.26 -0.882 . . . . 0.0 110.985 -179.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.596 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 53.7 tp60 -116.45 158.62 23.26 Favored 'General case' 0 C--O 1.237 0.407 0 CA-C-N 115.313 -0.858 . . . . 0.0 110.716 -179.418 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.534 HG22 ' CE1' ' A' ' 19' ' ' TYR . 39.9 p -94.0 126.49 39.25 Favored 'General case' 0 N--CA 1.467 0.417 0 CA-C-N 115.653 -0.703 . . . . 0.0 111.791 -179.415 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.593 ' O ' ' N ' ' A' ' 18' ' ' ARG . 2.7 p90 -145.18 140.29 27.82 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.327 -0.852 . . . . 0.0 109.055 179.312 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 1.045 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -89.08 101.26 11.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 C-N-CA 123.45 0.7 . . . . 0.0 112.526 -178.167 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 77.5 t80 -73.71 148.54 42.57 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 116.14 -0.482 . . . . 0.0 110.234 178.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -140.78 -172.97 13.23 Favored Glycine 0 C--N 1.338 0.641 0 C-N-CA 120.944 -0.646 . . . . 0.0 113.34 -179.597 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -94.5 1.58 66.68 Favored Glycine 0 C--N 1.34 0.767 0 O-C-N 123.767 0.334 . . . . 0.0 113.266 179.991 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -85.57 -37.71 19.28 Favored 'General case' 0 N--CA 1.467 0.418 0 N-CA-C 112.744 0.646 . . . . 0.0 112.744 179.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.489 ' HE ' ' HD2' ' A' ' 11' ' ' PRO . 88.6 mtt-85 -137.05 111.85 8.82 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-O 120.936 0.398 . . . . 0.0 111.101 179.593 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -93.85 144.01 25.82 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.508 -0.769 . . . . 0.0 110.918 -179.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.45 ' NZ ' ' HB3' ' A' ' 5' ' ' GLU . 4.6 tmtp? -134.78 -128.04 0.16 Allowed 'General case' 0 CA--C 1.55 0.946 0 O-C-N 123.464 0.477 . . . . 0.0 110.744 -179.315 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 78.2 mtm180 -144.28 -32.38 0.43 Allowed 'General case' 0 C--N 1.351 0.667 0 CA-C-N 118.185 0.448 . . . . 0.0 112.146 179.79 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . . . . . . . . . 0.4 OUTLIER -89.43 102.02 14.7 Favored 'General case' 0 C--O 1.237 0.409 0 CA-C-O 121.416 0.627 . . . . 0.0 111.363 -179.066 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.711 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 69.7 m-80 -144.64 116.92 8.46 Favored 'General case' 0 C--O 1.238 0.481 0 CA-C-N 114.617 -1.174 . . . . 0.0 110.862 178.48 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.431 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 70.3 m-85 -138.79 108.06 6.1 Favored 'General case' 0 CA--C 1.531 0.23 0 CA-C-N 115.937 -0.574 . . . . 0.0 111.528 -179.607 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 28.4 mmmt -62.97 -16.81 60.9 Favored 'General case' 0 N--CA 1.478 0.942 0 N-CA-C 112.943 0.72 . . . . 0.0 112.943 -179.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 60.0 p -130.98 136.68 48.76 Favored 'General case' 0 C--O 1.238 0.473 0 CA-C-O 120.731 0.3 . . . . 0.0 111.28 179.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.437 ' HB2' ' CE2' ' A' ' 19' ' ' TYR . . . -60.83 -43.12 98.69 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.848 -0.614 . . . . 0.0 111.444 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -48.6 -61.75 1.86 Allowed 'General case' 0 N--CA 1.476 0.865 0 O-C-N 123.857 0.723 . . . . 0.0 110.908 179.698 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 -61.8 -38.24 87.38 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 122.433 0.293 . . . . 0.0 111.176 178.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.489 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 47.0 t -54.49 -60.04 3.88 Favored 'General case' 0 N--CA 1.476 0.875 0 O-C-N 123.653 0.596 . . . . 0.0 110.754 179.257 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.638 ' HB3' ' HA3' ' A' ' 55' ' ' GLY . 68.4 mtt -60.98 -40.5 93.69 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 123.061 0.545 . . . . 0.0 112.103 179.397 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 37.1 mmt180 -65.23 -30.72 71.63 Favored 'General case' 0 N--CA 1.477 0.882 0 N-CA-C 113.331 0.863 . . . . 0.0 113.331 -179.56 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.407 HG21 ' HZ ' ' A' ' 43' ' ' PHE . 21.3 m -82.46 -50.3 9.01 Favored 'General case' 0 N--CA 1.472 0.65 0 O-C-N 122.921 0.138 . . . . 0.0 110.848 -179.957 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.489 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -86.98 -58.98 2.39 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 112.368 0.507 . . . . 0.0 112.368 -179.978 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 150.08 100.91 0.22 Allowed Glycine 0 C--N 1.342 0.869 0 C-N-CA 120.978 -0.629 . . . . 0.0 112.464 -179.761 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . 0.638 ' HA3' ' HB3' ' A' ' 50' ' ' MET . . . -97.29 -48.1 2.08 Favored Glycine 0 C--N 1.337 0.623 0 C-N-CA 121.523 -0.37 . . . . 0.0 112.81 -179.951 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.026 0 CA-C-O 118.25 -0.881 . . . . 0.0 111.147 179.972 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 45.4 p30 . . . . . 0 N--CA 1.489 1.484 0 CA-C-O 120.493 0.187 . . . . 0.0 111.379 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.3 OUTLIER -124.33 175.01 7.35 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.884 -0.598 . . . . 0.0 111.402 179.981 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.574 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 11.7 t 70.5 -15.67 0.35 Allowed 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 124.48 1.112 . . . . 0.0 113.193 179.419 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 0.1 OUTLIER -79.5 -14.25 59.0 Favored 'General case' 0 N--CA 1.466 0.344 0 N-CA-C 112.008 0.373 . . . . 0.0 112.008 -179.429 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -100.41 155.66 36.12 Favored Pre-proline 0 CA--C 1.536 0.423 0 CA-C-N 116.101 -0.5 . . . . 0.0 110.198 179.217 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_exo -57.21 165.28 5.61 Favored 'Trans proline' 0 C--N 1.374 1.872 0 C-N-CA 122.809 2.339 . . . . 0.0 112.827 -179.967 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.571 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 28.9 Cg_endo -55.3 134.17 62.29 Favored 'Trans proline' 0 C--N 1.376 1.98 0 C-N-CA 123.318 2.679 . . . . 0.0 113.172 -179.853 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.563 ' HD2' ' HB3' ' A' ' 39' ' ' LYS . 3.6 t80 -87.1 22.02 2.18 Favored 'General case' 0 CA--C 1.546 0.806 0 O-C-N 123.505 0.503 . . . . 0.0 112.057 -179.064 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.645 HG23 HG12 ' A' ' 32' ' ' VAL . 20.2 m -50.17 -31.38 13.48 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.076 0.55 . . . . 0.0 111.287 179.078 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 37.87 -133.29 1.25 Allowed Glycine 0 C--N 1.352 1.454 0 O-C-N 124.126 0.891 . . . . 0.0 114.026 178.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -83.32 3.93 7.41 Favored 'Trans proline' 0 C--N 1.366 1.486 0 C-N-CA 123.062 2.508 . . . . 0.0 112.51 178.915 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 2.7 m -97.27 140.96 30.97 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 116.043 -0.526 . . . . 0.0 110.16 -179.653 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.9 mmmp? -148.58 85.87 1.51 Allowed 'General case' 0 C--O 1.239 0.518 0 CA-C-O 121.261 0.553 . . . . 0.0 110.444 -179.866 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.421 ' O ' HG21 ' A' ' 32' ' ' VAL . . . -91.36 -171.4 2.93 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.619 -0.719 . . . . 0.0 110.999 179.81 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.2 OUTLIER -109.19 35.82 3.13 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-O 121.158 0.504 . . . . 0.0 112.035 -179.579 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 17.4 mt -135.11 95.01 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 115.879 -0.6 . . . . 0.0 109.566 179.706 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 1.042 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.9 mp -93.87 138.86 19.45 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 121.74 0.781 . . . . 0.0 110.017 -179.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.796 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 31.6 mtt180 -127.38 -153.19 0.55 Allowed 'General case' 0 C--N 1.32 -0.685 0 CA-C-N 113.497 -1.683 . . . . 0.0 109.546 -179.387 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 3.4 m-85 -116.4 170.7 8.35 Favored 'General case' 0 N--CA 1.472 0.629 0 CA-C-N 118.509 0.595 . . . . 0.0 112.262 -179.501 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.646 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 9.3 p90 -159.52 167.76 27.82 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.571 1.169 . . . . 0.0 110.362 176.5 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.612 ' CD2' ' HB2' ' A' ' 53' ' ' CYS . 5.2 t80 -106.65 102.05 11.46 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 112.969 0.729 . . . . 0.0 112.969 -179.231 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.0 OUTLIER -77.43 86.48 3.81 Favored 'General case' 0 C--O 1.237 0.433 0 CA-C-O 121.717 0.77 . . . . 0.0 109.095 178.616 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.432 ' HB2' ' CE2' ' A' ' 21' ' ' TYR . . . -71.12 0.73 7.03 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.763 -1.108 . . . . 0.0 111.605 -179.59 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 32.8 ttpt -95.02 -34.15 12.45 Favored 'General case' 0 C--N 1.351 0.659 0 N-CA-C 109.378 -0.601 . . . . 0.0 109.378 178.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -93.32 -49.01 6.16 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.17 178.798 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 145.38 -57.76 0.52 Allowed Glycine 0 C--N 1.343 0.963 0 O-C-N 123.452 0.47 . . . . 0.0 112.853 179.47 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.8 pp -89.88 -175.4 4.59 Favored 'General case' 0 CA--C 1.546 0.803 0 N-CA-C 113.52 0.933 . . . . 0.0 113.52 -178.02 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 64.3 m -99.59 136.76 39.05 Favored 'General case' 0 C--O 1.234 0.258 0 CA-C-N 114.785 -1.098 . . . . 0.0 110.666 179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.646 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 20.9 tt0 -111.05 -151.29 0.48 Allowed 'General case' 0 C--O 1.243 0.744 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 179.612 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.653 ' HA ' ' HA ' ' A' ' 19' ' ' TYR . 34.1 p -138.69 135.35 34.72 Favored 'General case' 0 C--N 1.353 0.756 0 CA-C-N 118.789 0.722 . . . . 0.0 111.468 -179.957 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.719 ' O ' ' N ' ' A' ' 18' ' ' ARG . 1.3 p90 -133.87 165.55 24.73 Favored 'General case' 0 N--CA 1.47 0.558 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.777 179.518 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 1.042 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.2 p -78.16 -163.2 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.114 0 C-N-CA 123.398 0.679 . . . . 0.0 111.533 -179.782 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.724 ' H ' HG22 ' A' ' 32' ' ' VAL . 64.7 t80 -169.31 113.37 0.53 Allowed 'General case' 0 C--O 1.238 0.45 0 C-N-CA 124.145 0.978 . . . . 0.0 108.983 178.494 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -117.87 160.65 13.66 Favored Glycine 0 C--N 1.334 0.424 0 CA-C-N 115.875 -0.602 . . . . 0.0 112.585 -179.692 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -88.25 44.75 3.22 Favored Glycine 0 C--N 1.338 0.653 0 C-N-CA 121.487 -0.387 . . . . 0.0 112.368 179.708 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.5 p -95.27 -49.15 5.6 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 122.478 0.311 . . . . 0.0 111.207 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 2.3 mpt_? -130.99 -37.34 1.29 Allowed 'General case' 0 N--CA 1.467 0.42 0 O-C-N 123.288 0.368 . . . . 0.0 111.485 179.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 53.86 113.65 0.0 OUTLIER 'General case' 0 N--CA 1.487 1.39 0 C-N-CA 124.123 0.969 . . . . 0.0 112.861 179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.563 ' HB3' ' HD2' ' A' ' 8' ' ' TYR . 5.0 pttt -124.75 166.13 16.73 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.887 -0.597 . . . . 0.0 110.804 179.802 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 19.9 mmm180 -83.34 57.45 4.0 Favored 'General case' 0 N--CA 1.471 0.603 0 N-CA-C 112.393 0.516 . . . . 0.0 112.393 -178.655 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.493 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.3 OUTLIER -148.58 92.82 2.05 Favored 'General case' 0 N--CA 1.469 0.51 0 CA-C-N 116.15 -0.477 . . . . 0.0 110.664 178.632 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.796 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 9.1 m120 -156.9 143.97 18.69 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-N 115.503 -0.771 . . . . 0.0 110.2 178.498 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.483 ' CD2' ' HA ' ' A' ' 49' ' ' CYS . 31.3 m-85 -136.65 147.21 46.74 Favored 'General case' 0 N--CA 1.47 0.531 0 N-CA-C 113.828 1.048 . . . . 0.0 113.828 179.002 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -96.76 -43.38 7.55 Favored 'General case' 0 CA--C 1.534 0.346 0 CA-C-N 114.687 -1.142 . . . . 0.0 112.576 -178.608 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.6 m -127.46 158.63 36.86 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -65.44 -59.6 3.83 Favored 'General case' 0 C--N 1.35 0.588 0 CA-C-N 115.457 -0.792 . . . . 0.0 111.778 179.802 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 3.8 tp10 -48.62 -39.96 25.93 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.317 0.647 . . . . 0.0 111.64 -179.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -74.43 -34.87 63.34 Favored 'General case' 0 C--O 1.242 0.679 0 CA-C-N 116.076 -0.511 . . . . 0.0 109.997 178.228 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.483 ' HA ' ' CD2' ' A' ' 43' ' ' PHE . 45.2 t -67.75 -23.74 65.27 Favored 'General case' 0 C--N 1.349 0.556 0 CA-C-N 115.359 -0.837 . . . . 0.0 110.692 177.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.621 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 94.3 mtp -83.71 -51.86 6.9 Favored 'General case' 0 C--O 1.237 0.413 0 N-CA-C 109.508 -0.553 . . . . 0.0 109.508 178.304 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 66.5 ttt180 -49.18 -38.47 25.95 Favored 'General case' 0 N--CA 1.474 0.736 0 CA-C-N 115.732 -0.667 . . . . 0.0 111.057 179.058 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.2 m -92.5 -49.78 5.95 Favored 'General case' 0 CA--C 1.546 0.792 0 CA-C-N 116.149 -0.478 . . . . 0.0 110.187 178.666 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.612 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 1.6 p -128.34 65.25 1.4 Allowed 'General case' 0 CA--C 1.542 0.665 0 N-CA-C 112.655 0.613 . . . . 0.0 112.655 179.852 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.621 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . -168.9 73.88 0.13 Allowed Glycine 0 C--N 1.337 0.614 0 CA-C-N 116.01 -0.541 . . . . 0.0 112.438 179.551 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.68 76.67 0.03 OUTLIER Glycine 0 C--N 1.338 0.641 0 C-N-CA 121.456 -0.402 . . . . 0.0 112.499 -179.976 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.055 0 CA-C-O 118.208 -0.901 . . . . 0.0 111.128 179.993 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.432 0 CA-C-O 120.583 0.23 . . . . 0.0 111.095 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 2.0 p90 -119.65 175.5 5.83 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 115.87 -0.605 . . . . 0.0 111.361 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.594 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 22.9 t 71.6 -37.31 0.39 Allowed 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.647 1.179 . . . . 0.0 112.955 179.536 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.2 mp -82.71 -10.61 58.83 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 111.764 0.283 . . . . 0.0 111.764 179.567 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -90.72 157.04 44.46 Favored Pre-proline 0 CA--C 1.539 0.538 0 CA-C-N 116.171 -0.468 . . . . 0.0 110.659 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -57.8 143.19 96.01 Favored 'Trans proline' 0 C--N 1.374 1.88 0 C-N-CA 122.79 2.327 . . . . 0.0 113.181 -179.765 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.54 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 39.8 Cg_endo -59.14 128.6 28.26 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 123.468 2.779 . . . . 0.0 113.824 -179.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.653 ' HE2' ' HD3' ' A' ' 37' ' ' ARG . 81.4 t80 -129.6 100.93 5.7 Favored 'General case' 0 C--O 1.238 0.489 0 CA-C-N 115.721 -0.672 . . . . 0.0 110.738 -179.765 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.483 HG23 ' N ' ' A' ' 34' ' ' GLY . 90.3 m -96.6 -79.65 0.45 Allowed 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 109.412 -0.588 . . . . 0.0 109.412 178.71 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.414 ' HA2' ' HD3' ' A' ' 11' ' ' PRO . . . 128.57 131.79 3.46 Favored Glycine 0 C--N 1.338 0.652 0 CA-C-O 118.83 -0.983 . . . . 0.0 110.666 -178.941 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.414 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 15.1 Cg_exo -68.89 72.3 1.05 Allowed 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.704 2.27 . . . . 0.0 112.608 -179.141 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 51.2 m -126.02 -107.66 0.32 Allowed 'General case' 0 CA--C 1.54 0.577 0 CA-C-N 115.517 -0.765 . . . . 0.0 111.042 -179.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 2.5 mptp? -132.0 73.25 1.52 Allowed 'General case' 0 C--O 1.239 0.509 0 CA-C-O 121.444 0.64 . . . . 0.0 109.986 179.816 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.525 ' HB1' HG12 ' A' ' 32' ' ' VAL . . . -97.75 116.59 30.27 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.291 -0.868 . . . . 0.0 111.638 -179.501 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -139.3 33.31 2.09 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.539 -0.755 . . . . 0.0 110.836 179.547 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.559 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 43.1 mt -138.46 121.35 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.448 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.362 -179.882 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.654 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.1 mp -95.47 144.6 9.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.888 0 N-CA-C 109.145 -0.687 . . . . 0.0 109.145 179.185 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.863 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 57.4 mtt180 -143.86 -174.74 4.34 Favored 'General case' 0 CA--C 1.538 0.484 0 CA-C-N 114.203 -1.362 . . . . 0.0 110.492 -177.562 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.592 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.1 m-85 -114.63 146.14 41.18 Favored 'General case' 0 N--CA 1.467 0.408 0 CA-C-O 120.985 0.422 . . . . 0.0 112.051 -179.283 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.61 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 4.0 p90 -139.76 153.96 47.28 Favored 'General case' 0 CA--C 1.535 0.37 0 CA-C-N 115.023 -0.99 . . . . 0.0 108.731 178.69 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.501 ' CZ ' ' HA2' ' A' ' 26' ' ' GLY . 63.0 t80 -98.74 135.18 40.59 Favored 'General case' 0 C--O 1.235 0.327 0 N-CA-C 112.531 0.567 . . . . 0.0 112.531 -179.241 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 68.3 m-80 -101.09 139.65 36.47 Favored 'General case' 0 C--O 1.239 0.544 0 N-CA-C 108.073 -1.084 . . . . 0.0 108.073 176.205 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -96.19 2.87 53.4 Favored 'General case' 0 C--O 1.237 0.439 0 CA-C-N 116.543 -0.299 . . . . 0.0 110.811 178.945 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 56.6 tttm -99.1 -38.1 9.07 Favored 'General case' 0 C--N 1.344 0.362 0 N-CA-C 109.277 -0.638 . . . . 0.0 109.277 178.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -104.53 -25.46 12.76 Favored 'General case' 0 C--O 1.235 0.329 0 CA-C-N 114.774 -1.103 . . . . 0.0 111.879 -179.66 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.501 ' HA2' ' CZ ' ' A' ' 21' ' ' TYR . . . 67.02 53.18 28.01 Favored Glycine 0 C--N 1.348 1.244 0 C-N-CA 121.341 -0.457 . . . . 0.0 112.637 -179.73 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.3 pp -153.17 164.71 37.57 Favored 'General case' 0 C--O 1.239 0.523 0 C-N-CA 122.688 0.395 . . . . 0.0 111.012 -179.989 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.557 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 92.3 m -99.51 109.2 21.76 Favored 'General case' 0 C--O 1.237 0.414 0 CA-C-N 115.802 -0.636 . . . . 0.0 110.15 179.338 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.592 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 0.0 OUTLIER -97.64 157.64 15.93 Favored 'General case' 0 N--CA 1.465 0.322 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.708 -178.852 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.519 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 34.6 p -87.78 130.09 34.97 Favored 'General case' 0 N--CA 1.471 0.604 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.517 -179.9 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.61 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 7.5 p90 -152.36 152.64 32.32 Favored 'General case' 0 CA--C 1.542 0.644 0 CA-C-N 115.812 -0.631 . . . . 0.0 110.214 -179.915 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.654 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.1 t -77.44 161.38 4.52 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.851 0 C-N-CA 123.628 0.771 . . . . 0.0 112.545 -177.898 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.648 ' OH ' ' HB1' ' A' ' 38' ' ' ALA . 12.3 t80 -132.1 143.1 49.77 Favored 'General case' 0 C--O 1.235 0.335 0 CA-C-N 114.372 -1.285 . . . . 0.0 109.571 -179.277 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.483 ' N ' HG23 ' A' ' 9' ' ' THR . . . -100.09 -161.1 28.47 Favored Glycine 0 C--N 1.337 0.597 0 C-N-CA 120.952 -0.642 . . . . 0.0 113.113 -179.348 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -144.06 3.26 1.47 Allowed Glycine 0 C--N 1.341 0.818 0 C-N-CA 121.139 -0.553 . . . . 0.0 114.094 -179.531 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 25.7 p -84.24 -53.5 5.45 Favored 'General case' 0 N--CA 1.471 0.624 0 CA-C-N 117.461 0.63 . . . . 0.0 110.534 179.431 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.653 ' HD3' ' HE2' ' A' ' 8' ' ' TYR . 54.7 ttt-85 -102.54 -84.54 0.45 Allowed 'General case' 0 CA--C 1.536 0.414 0 N-CA-C 107.436 -1.32 . . . . 0.0 107.436 177.583 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.648 ' HB1' ' OH ' ' A' ' 33' ' ' TYR . . . 81.91 126.18 0.04 OUTLIER 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.347 1.059 . . . . 0.0 112.173 179.057 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 4.1 mmtp -112.36 -178.12 3.33 Favored 'General case' 0 C--O 1.236 0.381 0 CA-C-N 115.363 -0.835 . . . . 0.0 110.616 179.948 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 88.4 mtm180 -91.92 6.47 46.09 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 115.407 -0.815 . . . . 0.0 112.474 -179.038 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.634 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.2 OUTLIER -96.5 76.51 2.9 Favored 'General case' 0 C--O 1.238 0.456 0 CA-C-O 121.032 0.444 . . . . 0.0 110.769 179.857 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.863 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 7.7 m120 -156.94 134.23 10.54 Favored 'General case' 0 N--CA 1.467 0.381 0 CA-C-N 115.805 -0.634 . . . . 0.0 111.199 178.571 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.569 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 32.4 m-85 -134.24 105.5 6.67 Favored 'General case' 0 CA--C 1.532 0.25 0 CA-C-N 115.371 -0.832 . . . . 0.0 110.293 179.331 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.7 tptm -73.27 -4.61 34.2 Favored 'General case' 0 CA--C 1.546 0.816 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -178.875 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.9 m -131.15 135.05 47.12 Favored 'General case' 0 C--O 1.238 0.498 0 CA-C-O 120.753 0.311 . . . . 0.0 111.512 179.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.52 -43.52 84.99 Favored 'General case' 0 N--CA 1.47 0.563 0 CA-C-N 115.636 -0.711 . . . . 0.0 111.411 179.474 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -50.91 -56.19 13.54 Favored 'General case' 0 N--CA 1.478 0.973 0 O-C-N 123.667 0.605 . . . . 0.0 111.279 179.902 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -64.91 -48.93 72.39 Favored 'General case' 0 C--N 1.349 0.567 0 CA-C-N 116.682 -0.236 . . . . 0.0 110.443 178.744 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.568 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 43.1 t -48.02 -47.15 33.64 Favored 'General case' 0 N--CA 1.478 0.93 0 O-C-N 123.729 0.643 . . . . 0.0 111.336 179.864 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.7 mtt -70.19 -42.74 71.97 Favored 'General case' 0 CA--C 1.537 0.465 0 C-N-CA 122.311 0.244 . . . . 0.0 111.405 178.855 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 99.6 mtt180 -69.5 -15.05 63.18 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 112.915 0.709 . . . . 0.0 112.915 179.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.6 m -107.38 -51.88 2.85 Favored 'General case' 0 CA--C 1.541 0.607 0 O-C-N 122.952 0.158 . . . . 0.0 111.297 -179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.568 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.8 OUTLIER -111.11 18.33 19.5 Favored 'General case' 0 CA--C 1.54 0.572 0 N-CA-C 113.184 0.809 . . . . 0.0 113.184 -178.967 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -111.05 -79.03 0.99 Allowed Glycine 0 C--N 1.34 0.798 0 C-N-CA 120.698 -0.763 . . . . 0.0 112.478 178.681 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 128.1 98.56 0.96 Allowed Glycine 0 C--N 1.337 0.585 0 C-N-CA 121.474 -0.393 . . . . 0.0 112.479 179.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.065 0 CA-C-O 118.299 -0.858 . . . . 0.0 111.054 -179.963 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.511 0.196 . . . . 0.0 111.158 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.551 ' CD2' ' HB3' ' A' ' 40' ' ' ARG . 3.7 p90 -111.18 149.27 31.17 Favored 'General case' 0 N--CA 1.465 0.292 0 CA-C-N 115.844 -0.616 . . . . 0.0 111.125 -179.953 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 46.5 t 175.35 -39.52 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.255 0.622 . . . . 0.0 110.864 178.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.826 HD11 ' HA ' ' A' ' 56' ' ' ALA . 6.1 mp -87.43 17.78 4.28 Favored 'General case' 0 CA--C 1.542 0.635 0 O-C-N 123.402 0.439 . . . . 0.0 111.862 -179.514 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.464 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 5.8 mm-40 -96.16 122.52 57.81 Favored Pre-proline 0 CA--C 1.539 0.52 0 CA-C-N 116.326 -0.397 . . . . 0.0 111.077 179.721 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.435 ' HD3' ' HA ' ' A' ' 5' ' ' GLU . 2.8 Cg_exo -76.71 165.62 28.45 Favored 'Trans proline' 0 C--N 1.368 1.577 0 C-N-CA 123.062 2.508 . . . . 0.0 112.558 -179.849 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.595 ' HB3' ' HB2' ' A' ' 31' ' ' PHE . 28.3 Cg_endo -55.08 135.63 69.63 Favored 'Trans proline' 0 C--N 1.376 2.021 0 C-N-CA 123.372 2.715 . . . . 0.0 113.386 179.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.407 ' C ' ' H ' ' A' ' 10' ' ' GLY . 2.7 t80 -95.95 28.67 3.03 Favored 'General case' 0 CA--C 1.547 0.833 0 CA-C-N 116.046 -0.525 . . . . 0.0 111.972 -178.962 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.646 HG23 HG11 ' A' ' 32' ' ' VAL . 14.1 m -49.65 -4.86 0.02 OUTLIER 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 113.743 1.016 . . . . 0.0 113.743 -179.556 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.407 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . -27.09 131.35 0.04 OUTLIER Glycine 0 N--CA 1.477 1.399 0 CA-C-O 118.219 -1.323 . . . . 0.0 112.42 178.605 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 33.5 Cg_exo -16.91 77.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.377 2.076 1 C-N-CA 125.664 4.243 . . . . 0.0 116.013 -178.367 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 77.6 m -134.09 176.52 8.51 Favored 'General case' 0 N--CA 1.469 0.49 0 CA-C-N 115.065 -0.97 . . . . 0.0 111.358 -179.749 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 28.8 mtpp -87.27 55.44 3.54 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-O 121.891 0.853 . . . . 0.0 109.941 179.207 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.65 ' HA ' ' HA2' ' A' ' 34' ' ' GLY . . . -80.95 113.44 19.16 Favored 'General case' 0 C--O 1.237 0.408 0 CA-C-N 114.441 -1.254 . . . . 0.0 111.857 -179.432 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.689 ' O ' HG13 ' A' ' 16' ' ' ILE . 5.8 tpm_? -133.71 33.33 3.49 Favored 'General case' 0 CA--C 1.542 0.666 0 CA-C-N 115.288 -0.869 . . . . 0.0 110.723 -179.807 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.689 HG13 ' O ' ' A' ' 15' ' ' ARG . 31.4 mt -154.94 113.83 0.31 Allowed 'Isoleucine or valine' 0 N--CA 1.469 0.481 0 CA-C-N 115.865 -0.607 . . . . 0.0 109.43 179.844 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 1.048 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.8 mp -91.42 115.63 30.92 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 CA-C-O 122.312 1.053 . . . . 0.0 109.902 179.969 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.734 ' N ' ' O ' ' A' ' 31' ' ' PHE . 2.2 mmp_? -100.8 -156.12 0.54 Allowed 'General case' 0 C--N 1.317 -0.835 0 CA-C-N 112.428 -2.169 . . . . 0.0 110.081 179.81 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 4.8 m-85 -123.75 166.7 15.11 Favored 'General case' 0 N--CA 1.472 0.669 0 N-CA-C 112.15 0.426 . . . . 0.0 112.15 -179.583 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.822 ' HA ' ' HD2' ' A' ' 43' ' ' PHE . 8.4 p90 -162.91 170.96 17.34 Favored 'General case' 0 N--CA 1.476 0.846 0 CA-C-N 115.118 -0.946 . . . . 0.0 110.168 176.337 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.633 ' HB2' ' SG ' ' A' ' 49' ' ' CYS . 0.8 OUTLIER -115.74 107.91 15.67 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 122.479 0.312 . . . . 0.0 111.408 -178.852 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.53 ' ND2' ' HB2' ' A' ' 29' ' ' GLN . 65.5 m-80 -76.49 97.55 4.36 Favored 'General case' 0 C--O 1.243 0.756 0 CA-C-O 121.451 0.643 . . . . 0.0 112.064 -178.758 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.464 ' CB ' ' HG ' ' A' ' 4' ' ' LEU . . . -76.62 24.07 0.15 Allowed 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.012 -0.994 . . . . 0.0 109.881 177.912 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.5 ' H ' ' C ' ' A' ' 22' ' ' ASN . 12.7 tmtt? -98.73 -39.95 8.39 Favored 'General case' 0 C--N 1.35 0.624 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 177.466 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -108.96 -51.75 2.84 Favored 'General case' 0 N--CA 1.453 -0.296 0 CA-C-N 114.422 -1.263 . . . . 0.0 109.988 179.002 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 144.2 -35.18 1.59 Allowed Glycine 0 C--N 1.348 1.247 0 C-N-CA 121.246 -0.502 . . . . 0.0 112.972 179.929 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.7 pp -87.68 169.28 12.26 Favored 'General case' 0 CA--C 1.544 0.721 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -178.217 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.486 ' HA ' ' HA ' ' A' ' 21' ' ' TYR . 94.7 m -98.84 139.91 33.81 Favored 'General case' 0 C--N 1.344 0.328 0 CA-C-N 114.915 -1.039 . . . . 0.0 110.386 179.29 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.53 ' HB2' ' ND2' ' A' ' 22' ' ' ASN . 67.7 mt-30 -132.73 158.76 41.57 Favored 'General case' 0 C--O 1.236 0.36 0 O-C-N 123.466 0.479 . . . . 0.0 110.98 179.89 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.53 ' HA ' ' HA ' ' A' ' 19' ' ' TYR . 45.1 p -85.65 121.44 28.33 Favored 'General case' 0 CA--C 1.535 0.368 0 N-CA-C 113.735 1.013 . . . . 0.0 113.735 -177.412 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.734 ' O ' ' N ' ' A' ' 18' ' ' ARG . 0.0 OUTLIER -113.54 178.81 4.15 Favored 'General case' 0 C--O 1.215 -0.753 0 N-CA-C 107.929 -1.137 . . . . 0.0 107.929 176.682 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 1.048 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.3 p -91.4 -159.16 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.551 1.011 0 CA-C-N 118.794 0.724 . . . . 0.0 110.897 179.802 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.785 ' H ' HG22 ' A' ' 32' ' ' VAL . 77.2 t80 -173.49 111.34 0.19 Allowed 'General case' 0 N--CA 1.467 0.405 0 C-N-CA 124.514 1.125 . . . . 0.0 108.564 177.914 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.65 ' HA2' ' HA ' ' A' ' 14' ' ' ALA . . . -92.59 163.26 27.2 Favored Glycine 0 C--N 1.336 0.571 0 CA-C-N 115.798 -0.637 . . . . 0.0 112.743 -179.418 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.31 26.42 11.83 Favored Glycine 0 C--N 1.337 0.587 0 C-N-CA 121.372 -0.442 . . . . 0.0 113.133 -179.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 29.0 p -95.59 -51.02 4.71 Favored 'General case' 0 C--O 1.235 0.312 0 C-N-CA 122.185 0.194 . . . . 0.0 111.072 179.756 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 87.5 mtt-85 -145.18 139.8 27.49 Favored 'General case' 0 N--CA 1.469 0.503 0 O-C-N 123.317 0.385 . . . . 0.0 111.441 -179.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -99.69 118.63 36.61 Favored 'General case' 0 C--O 1.237 0.41 0 CA-C-N 115.532 -0.758 . . . . 0.0 109.769 178.865 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 1.0 OUTLIER -99.76 -171.46 2.06 Favored 'General case' 0 C--O 1.235 0.332 0 CA-C-O 121.236 0.541 . . . . 0.0 111.078 -179.238 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.551 ' HB3' ' CD2' ' A' ' 2' ' ' PHE . 40.1 mmt180 -82.38 -74.5 0.34 Allowed 'General case' 0 C--O 1.235 0.314 0 CA-C-N 114.839 -1.073 . . . . 0.0 110.428 179.365 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.464 ' HB2' ' HB2' ' A' ' 5' ' ' GLU . 0.3 OUTLIER -51.71 101.94 0.04 OUTLIER 'General case' 0 N--CA 1.471 0.618 0 N-CA-C 113.25 0.833 . . . . 0.0 113.25 -177.966 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.0 m-80 -148.67 136.19 20.46 Favored 'General case' 0 CA--C 1.515 -0.382 0 CA-C-N 114.022 -1.445 . . . . 0.0 109.311 177.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.822 ' HD2' ' HA ' ' A' ' 20' ' ' PHE . 59.4 m-85 -138.17 150.07 46.44 Favored 'General case' 0 C--N 1.331 -0.206 0 N-CA-C 113.063 0.764 . . . . 0.0 113.063 -179.171 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.572 ' HG3' ' NH1' ' A' ' 18' ' ' ARG . 0.7 OUTLIER -97.23 -46.02 6.29 Favored 'General case' 0 CA--C 1.533 0.297 0 CA-C-N 114.684 -1.144 . . . . 0.0 111.922 -179.594 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.496 ' HB2' ' OD2' ' A' ' 48' ' ' ASP . 52.9 m -133.3 168.09 19.21 Favored 'General case' 0 N--CA 1.47 0.543 0 O-C-N 123.199 0.312 . . . . 0.0 111.603 -179.174 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.439 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -63.25 -64.69 0.83 Allowed 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 122.875 0.47 . . . . 0.0 111.814 -179.919 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.474 ' O ' ' HD2' ' A' ' 51' ' ' ARG . 97.9 mt-10 -53.17 -34.75 58.23 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 122.809 0.444 . . . . 0.0 111.836 179.822 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.496 ' OD2' ' HB2' ' A' ' 45' ' ' SER . 54.8 m-20 -73.52 -33.32 64.7 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.269 178.274 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.661 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 33.9 t -63.84 -47.55 80.32 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-N 115.82 -0.627 . . . . 0.0 110.914 178.454 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.413 ' HB3' ' NH2' ' A' ' 51' ' ' ARG . 74.7 mtm -69.6 -48.22 60.87 Favored 'General case' 0 CA--C 1.538 0.491 0 CA-C-N 115.724 -0.671 . . . . 0.0 111.478 179.427 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.474 ' HD2' ' O ' ' A' ' 47' ' ' GLU . 0.0 OUTLIER -64.17 -30.41 71.47 Favored 'General case' 0 N--CA 1.474 0.731 0 N-CA-C 113.221 0.823 . . . . 0.0 113.221 -179.888 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.421 ' HB ' ' HE1' ' A' ' 43' ' ' PHE . 31.0 m -90.69 -32.0 16.36 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 112.052 0.39 . . . . 0.0 112.052 -179.48 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.56 ' HB3' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -80.85 -51.95 8.03 Favored 'General case' 0 N--CA 1.473 0.724 0 CA-C-N 117.856 0.298 . . . . 0.0 111.008 -179.782 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . 97.61 -51.54 1.36 Allowed Glycine 0 C--N 1.344 0.983 0 C-N-CA 121.358 -0.449 . . . . 0.0 112.61 -179.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 107.9 95.46 2.4 Favored Glycine 0 C--N 1.336 0.568 0 C-N-CA 121.389 -0.434 . . . . 0.0 112.535 179.88 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . 0.826 ' HA ' HD11 ' A' ' 4' ' ' LEU . . . . . . . . 0 N--CA 1.483 1.194 0 C-N-CA 124.058 0.943 . . . . 0.0 112.348 179.997 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 56.6 m-20 . . . . . 0 N--CA 1.488 1.448 0 CA-C-O 120.598 0.237 . . . . 0.0 110.939 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 32.8 p90 -138.52 -32.22 0.71 Allowed 'General case' 0 N--CA 1.468 0.467 0 CA-C-N 115.985 -0.552 . . . . 0.0 111.397 -179.608 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 48.9 t -77.25 -20.3 55.37 Favored 'General case' 0 N--CA 1.469 0.517 0 CA-C-N 115.634 -0.712 . . . . 0.0 112.855 -178.75 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 3.0 pp -88.05 23.78 2.0 Allowed 'General case' 0 CA--C 1.544 0.712 0 CA-C-O 120.952 0.406 . . . . 0.0 111.874 -179.923 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -96.01 155.31 38.42 Favored Pre-proline 0 CA--C 1.537 0.447 0 CA-C-N 115.969 -0.559 . . . . 0.0 110.784 179.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -63.3 141.45 81.94 Favored 'Trans proline' 0 C--N 1.373 1.856 0 C-N-CA 122.675 2.25 . . . . 0.0 113.452 -179.596 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.527 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 29.1 Cg_endo -54.81 133.87 59.86 Favored 'Trans proline' 0 C--N 1.372 1.766 0 C-N-CA 123.968 3.112 . . . . 0.0 114.029 -179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -135.54 103.53 5.49 Favored 'General case' 0 C--O 1.237 0.44 0 CA-C-N 115.609 -0.723 . . . . 0.0 110.592 -179.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.678 HG23 ' HA ' ' A' ' 33' ' ' TYR . 28.5 m -96.49 -78.06 0.47 Allowed 'General case' 0 CA--C 1.539 0.552 0 N-CA-C 109.869 -0.419 . . . . 0.0 109.869 179.131 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 114.26 146.81 9.38 Favored Glycine 0 C--N 1.342 0.898 0 CA-C-O 119.117 -0.824 . . . . 0.0 111.636 -179.25 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.515 ' HD2' HH22 ' A' ' 37' ' ' ARG . 7.9 Cg_exo -72.35 68.9 3.4 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 122.882 2.388 . . . . 0.0 112.247 -179.758 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 73.9 m -124.9 -152.8 0.53 Allowed 'General case' 0 CA--C 1.54 0.586 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.827 -179.436 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mptp? -87.25 57.65 4.58 Favored 'General case' 0 C--O 1.239 0.511 0 CA-C-O 121.834 0.826 . . . . 0.0 110.182 179.936 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.622 ' HA ' ' HA2' ' A' ' 34' ' ' GLY . . . -85.26 116.17 23.45 Favored 'General case' 0 C--O 1.236 0.389 0 CA-C-N 114.644 -1.162 . . . . 0.0 111.697 -179.695 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.502 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 3.4 ppt_? -142.16 21.77 2.08 Favored 'General case' 0 N--CA 1.474 0.752 0 CA-C-N 115.519 -0.764 . . . . 0.0 111.046 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 46.5 mt -131.96 116.05 29.0 Favored 'Isoleucine or valine' 0 C--N 1.326 -0.451 0 CA-C-N 115.045 -0.979 . . . . 0.0 110.223 -178.974 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.863 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.7 mp -92.83 106.68 18.17 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.699 0 CA-C-O 122.267 1.032 . . . . 0.0 109.355 179.338 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.617 ' N ' ' O ' ' A' ' 31' ' ' PHE . 51.2 mtt180 -98.2 174.58 6.44 Favored 'General case' 0 C--N 1.316 -0.877 0 CA-C-N 112.825 -1.989 . . . . 0.0 110.955 -179.446 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.53 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 1.5 m-85 -110.73 152.11 26.96 Favored 'General case' 0 C--O 1.238 0.461 0 CA-C-O 120.625 0.25 . . . . 0.0 111.093 -179.831 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.587 ' CE1' ' HB3' ' A' ' 29' ' ' GLN . 2.4 p90 -139.83 157.46 45.68 Favored 'General case' 0 C--O 1.237 0.435 0 N-CA-C 108.737 -0.838 . . . . 0.0 108.737 178.452 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.592 ' CZ ' ' HA2' ' A' ' 26' ' ' GLY . 80.9 t80 -90.71 129.83 36.76 Favored 'General case' 0 C--O 1.236 0.373 0 CA-C-O 120.734 0.302 . . . . 0.0 111.366 179.741 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.612 ' HB2' HD13 ' A' ' 27' ' ' LEU . 3.2 m120 -96.58 127.66 42.77 Favored 'General case' 0 C--O 1.241 0.63 0 N-CA-C 108.213 -1.032 . . . . 0.0 108.213 178.055 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.31 11.79 20.24 Favored 'General case' 0 C--O 1.239 0.526 0 O-C-N 123.416 0.447 . . . . 0.0 111.981 -179.308 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 9.0 mtpm? -97.42 -25.04 15.34 Favored 'General case' 0 C--O 1.235 0.294 0 CA-C-O 120.651 0.262 . . . . 0.0 110.916 179.304 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.894 ' HB3' HD12 ' A' ' 27' ' ' LEU . . . -138.38 -27.37 0.87 Allowed 'General case' 0 C--O 1.235 0.315 0 CA-C-N 115.699 -0.682 . . . . 0.0 112.731 -178.719 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.592 ' HA2' ' CZ ' ' A' ' 21' ' ' TYR . . . 99.09 8.66 53.45 Favored Glycine 0 C--N 1.344 1.009 0 C-N-CA 120.791 -0.719 . . . . 0.0 112.944 -179.367 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.894 HD12 ' HB3' ' A' ' 25' ' ' ALA . 0.0 OUTLIER -96.51 151.21 19.79 Favored 'General case' 0 C--O 1.236 0.382 0 CA-C-O 120.581 0.229 . . . . 0.0 111.344 -179.634 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 87.3 m -93.56 110.26 21.85 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.743 -0.662 . . . . 0.0 109.36 178.733 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.587 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 33.1 tt0 -88.0 159.14 18.42 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.458 -0.792 . . . . 0.0 112.048 -177.549 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.44 HG22 ' CE1' ' A' ' 19' ' ' TYR . 35.5 p -96.32 128.69 43.48 Favored 'General case' 0 N--CA 1.467 0.416 0 CA-C-N 115.049 -0.978 . . . . 0.0 111.442 -179.822 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.617 ' O ' ' N ' ' A' ' 18' ' ' ARG . 7.7 p90 -152.2 152.22 31.97 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 115.627 -0.715 . . . . 0.0 109.643 179.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.863 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -78.33 174.28 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.959 0 C-N-CA 123.491 0.717 . . . . 0.0 111.982 -177.824 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.678 ' HA ' HG23 ' A' ' 9' ' ' THR . 48.0 t80 -155.99 139.5 15.89 Favored 'General case' 0 N--CA 1.466 0.358 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.352 -179.81 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.622 ' HA2' ' HA ' ' A' ' 14' ' ' ALA . . . -102.59 -55.0 0.85 Allowed Glycine 0 C--N 1.338 0.685 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.187 179.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 98.36 27.37 8.7 Favored Glycine 0 C--N 1.336 0.578 0 C-N-CA 121.527 -0.368 . . . . 0.0 113.319 179.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 20.6 p -95.79 -43.07 8.03 Favored 'General case' 0 CA--C 1.533 0.3 0 C-N-CA 122.28 0.232 . . . . 0.0 111.545 179.948 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.515 HH22 ' HD2' ' A' ' 11' ' ' PRO . 84.4 mtm-85 -116.03 8.87 14.68 Favored 'General case' 0 CA--C 1.539 0.523 0 O-C-N 123.357 0.411 . . . . 0.0 111.644 179.897 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 12.2 118.19 0.0 OUTLIER 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 115.722 1.749 . . . . 0.0 115.722 179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -92.7 -124.69 0.09 Allowed 'General case' 0 CA--C 1.549 0.926 0 CA-C-N 115.669 -0.696 . . . . 0.0 109.721 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.4 mtm180 -140.46 -34.74 0.52 Allowed 'General case' 0 N--CA 1.471 0.577 0 CA-C-N 118.35 0.523 . . . . 0.0 111.47 179.826 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.441 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.4 OUTLIER -83.81 96.92 8.91 Favored 'General case' 0 CA--C 1.537 0.472 0 CA-C-O 121.004 0.43 . . . . 0.0 111.789 -179.062 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.582 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 8.7 m120 -154.92 118.48 4.53 Favored 'General case' 0 C--O 1.238 0.46 0 CA-C-N 115.403 -0.817 . . . . 0.0 111.271 177.803 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.53 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 28.8 m-85 -137.96 105.69 5.61 Favored 'General case' 0 C--N 1.329 -0.292 0 CA-C-N 115.444 -0.798 . . . . 0.0 110.726 -179.923 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 21.4 tptm -76.36 2.45 13.45 Favored 'General case' 0 CA--C 1.548 0.904 0 N-CA-C 111.977 0.362 . . . . 0.0 111.977 -179.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.5 m -135.77 132.12 36.37 Favored 'General case' 0 C--O 1.238 0.492 0 CA-C-N 116.597 -0.274 . . . . 0.0 111.222 179.748 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.69 -45.48 89.84 Favored 'General case' 0 N--CA 1.471 0.603 0 CA-C-N 115.838 -0.619 . . . . 0.0 111.392 179.549 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -48.39 -55.25 11.28 Favored 'General case' 0 N--CA 1.477 0.915 0 C-N-CA 123.426 0.69 . . . . 0.0 111.516 -179.901 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 54.8 m-20 -66.15 -45.63 80.32 Favored 'General case' 0 N--CA 1.472 0.663 0 C-N-CA 122.449 0.3 . . . . 0.0 110.749 178.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.425 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 44.7 t -47.06 -50.38 19.75 Favored 'General case' 0 N--CA 1.479 1.005 0 O-C-N 123.803 0.689 . . . . 0.0 111.393 179.922 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 94.9 mtp -77.38 -35.72 54.14 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 122.638 0.375 . . . . 0.0 111.973 179.458 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 65.0 ttt180 -62.47 -28.69 69.99 Favored 'General case' 0 N--CA 1.474 0.766 0 N-CA-C 112.305 0.483 . . . . 0.0 112.305 -179.838 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 9.8 m -104.09 -52.19 2.99 Favored 'General case' 0 CA--C 1.539 0.526 0 O-C-N 123.196 0.31 . . . . 0.0 110.944 -179.607 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.425 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.0 OUTLIER -99.45 19.71 15.12 Favored 'General case' 0 CA--C 1.538 0.482 0 N-CA-C 113.482 0.919 . . . . 0.0 113.482 -178.31 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -142.34 75.84 0.31 Allowed Glycine 0 C--N 1.342 0.874 0 C-N-CA 120.685 -0.769 . . . . 0.0 112.433 178.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -91.59 -54.55 1.92 Allowed Glycine 0 C--N 1.337 0.607 0 C-N-CA 121.554 -0.355 . . . . 0.0 112.772 -179.892 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.993 0 CA-C-O 118.332 -0.842 . . . . 0.0 111.196 -179.996 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.534 ' N ' HH22 ' A' ' 40' ' ' ARG . 47.1 t0 . . . . . 0 N--CA 1.486 1.373 0 CA-C-O 120.521 0.2 . . . . 0.0 110.619 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.421 ' HD1' ' SG ' ' A' ' 3' ' ' CYS . 12.3 p90 -130.94 -171.19 2.51 Favored 'General case' 0 CA--C 1.541 0.604 0 CA-C-N 115.851 -0.613 . . . . 0.0 110.936 179.995 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 67.8 m 72.54 -51.56 0.7 Allowed 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.379 1.071 . . . . 0.0 112.698 179.857 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 57.6 mt -79.35 -11.96 59.93 Favored 'General case' 0 N--CA 1.472 0.625 0 N-CA-C 112.437 0.532 . . . . 0.0 112.437 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.8 mt-10 -95.04 146.49 31.41 Favored Pre-proline 0 CA--C 1.535 0.398 0 O-C-N 123.18 0.3 . . . . 0.0 110.388 179.104 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 23.9 Cg_exo -65.17 163.0 30.59 Favored 'Trans proline' 0 C--N 1.369 1.631 0 C-N-CA 122.804 2.336 . . . . 0.0 112.725 -179.723 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.527 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 55.4 Cg_endo -62.44 153.11 73.13 Favored 'Trans proline' 0 C--N 1.373 1.823 0 C-N-CA 123.009 2.473 . . . . 0.0 112.448 179.88 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.738 ' HE2' ' HD3' ' A' ' 37' ' ' ARG . 2.0 t80 -88.31 22.15 2.59 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 112.125 0.417 . . . . 0.0 112.125 -179.29 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.698 HG22 ' HG3' ' A' ' 13' ' ' LYS . 7.1 m -55.6 -5.86 0.16 Allowed 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 122.94 0.496 . . . . 0.0 111.789 178.973 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.421 ' H ' ' C ' ' A' ' 8' ' ' TYR . . . -28.7 -90.52 0.01 OUTLIER Glycine 0 C--N 1.352 1.472 0 C-N-CA 124.253 0.93 . . . . 0.0 114.446 179.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 11.0 Cg_endo -89.58 14.37 2.18 Favored 'Trans proline' 0 C--N 1.362 1.273 0 C-N-CA 122.933 2.422 . . . . 0.0 113.38 179.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 3.1 m -137.97 122.49 18.46 Favored 'General case' 0 C--N 1.347 0.482 0 CA-C-O 120.603 0.24 . . . . 0.0 110.883 -179.324 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.698 ' HG3' HG22 ' A' ' 9' ' ' THR . 0.3 OUTLIER -141.53 82.66 1.83 Allowed 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.93 -0.577 . . . . 0.0 109.865 179.725 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -91.86 -170.83 2.68 Favored 'General case' 0 CA--C 1.541 0.628 0 CA-C-N 116.288 -0.414 . . . . 0.0 111.175 179.877 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -103.65 38.09 1.88 Allowed 'General case' 0 CA--C 1.541 0.608 0 CA-C-O 121.041 0.448 . . . . 0.0 112.133 -179.32 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 20.5 mt -129.96 102.02 6.7 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.551 0 CA-C-N 116.203 -0.453 . . . . 0.0 110.482 -179.852 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.923 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 44.9 mm -91.26 144.29 9.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 CA-C-N 115.653 -0.703 . . . . 0.0 109.772 179.611 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.8 ' N ' ' O ' ' A' ' 31' ' ' PHE . 4.0 ttt180 -134.8 -154.78 0.61 Allowed 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.114 -1.403 . . . . 0.0 109.657 -178.578 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.497 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 10.6 m-85 -120.33 156.36 31.47 Favored 'General case' 0 N--CA 1.471 0.62 0 CA-C-N 118.292 0.496 . . . . 0.0 111.73 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.581 ' HD1' ' O ' ' A' ' 29' ' ' GLN . 0.1 OUTLIER -164.75 179.91 6.27 Favored 'General case' 0 N--CA 1.479 1.015 0 CA-C-N 114.838 -1.073 . . . . 0.0 112.131 177.716 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.434 ' CD1' ' HB2' ' A' ' 53' ' ' CYS . 63.6 t80 -94.76 168.74 10.63 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 107.033 -1.469 . . . . 0.0 107.033 176.656 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 24.1 m-80 -142.95 123.54 14.05 Favored 'General case' 0 C--O 1.238 0.471 0 CA-C-N 120.056 1.298 . . . . 0.0 109.953 176.671 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -84.63 12.99 6.13 Favored 'General case' 0 CA--C 1.538 0.495 0 CA-C-N 115.527 -0.76 . . . . 0.0 110.603 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.536 ' HB2' ' HZ2' ' A' ' 24' ' ' LYS . 0.0 OUTLIER -98.35 -39.04 9.0 Favored 'General case' 0 C--N 1.35 0.623 0 CA-C-O 121.035 0.445 . . . . 0.0 110.477 178.789 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.06 -35.65 5.6 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 114.976 -1.011 . . . . 0.0 111.388 -179.638 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 117.06 -39.4 2.68 Favored Glycine 0 C--N 1.341 0.85 0 O-C-N 123.48 0.488 . . . . 0.0 112.615 -179.84 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.755 HD23 ' H ' ' A' ' 27' ' ' LEU . 1.2 pt? -82.59 -163.83 0.76 Allowed 'General case' 0 CA--C 1.548 0.887 0 N-CA-C 112.299 0.481 . . . . 0.0 112.299 -178.886 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 98.3 m -111.0 144.91 39.36 Favored 'General case' 0 C--N 1.347 0.469 0 CA-C-N 115.608 -0.724 . . . . 0.0 111.357 -179.555 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.581 ' O ' ' HD1' ' A' ' 20' ' ' PHE . 3.2 tp-100 -144.44 169.24 18.31 Favored 'General case' 0 CA--C 1.54 0.558 0 CA-C-N 115.72 -0.673 . . . . 0.0 109.611 179.796 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.8 p -87.09 126.94 35.09 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 112.94 0.718 . . . . 0.0 112.94 -178.115 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.8 ' O ' ' N ' ' A' ' 18' ' ' ARG . 1.8 p90 -122.64 170.93 9.53 Favored 'General case' 0 C--O 1.217 -0.631 0 CA-C-N 115.208 -0.905 . . . . 0.0 109.247 178.683 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.923 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.5 p -76.14 -161.74 0.04 OUTLIER 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 C-N-CA 123.449 0.699 . . . . 0.0 111.35 179.958 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.743 ' H ' HG22 ' A' ' 32' ' ' VAL . 71.2 t80 179.39 117.78 0.05 OUTLIER 'General case' 0 C--O 1.236 0.392 0 C-N-CA 124.681 1.192 . . . . 0.0 108.947 178.692 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -115.53 148.51 18.91 Favored Glycine 0 C--N 1.333 0.412 0 CA-C-N 115.981 -0.554 . . . . 0.0 112.34 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -86.13 46.97 3.69 Favored Glycine 0 C--N 1.34 0.755 0 C-N-CA 121.499 -0.381 . . . . 0.0 112.33 179.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.7 p -95.19 -46.25 6.85 Favored 'General case' 0 CA--C 1.533 0.3 0 O-C-N 123.873 0.396 . . . . 0.0 111.34 -179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.738 ' HD3' ' HE2' ' A' ' 8' ' ' TYR . 53.9 ttt-85 -137.9 -36.97 0.6 Allowed 'General case' 0 CA--C 1.536 0.424 0 O-C-N 123.372 0.42 . . . . 0.0 111.216 -179.835 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . 63.47 116.03 0.02 OUTLIER 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.59 0.756 . . . . 0.0 111.725 -179.569 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 7.5 mmtt -105.46 -163.67 0.96 Allowed 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 116.17 -0.468 . . . . 0.0 110.423 -179.566 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.534 HH22 ' N ' ' A' ' 1' ' ' ASP . 89.1 mtm180 -82.38 -76.08 0.28 Allowed 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.607 -0.724 . . . . 0.0 110.46 179.326 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.426 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.4 OUTLIER -39.65 99.2 0.02 OUTLIER 'General case' 0 N--CA 1.477 0.889 0 N-CA-C 114.11 1.152 . . . . 0.0 114.11 -177.817 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 73.1 m-20 -148.8 129.02 13.69 Favored 'General case' 0 C--O 1.235 0.337 0 CA-C-N 114.254 -1.339 . . . . 0.0 110.155 177.643 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.497 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 84.4 m-85 -134.19 148.02 50.84 Favored 'General case' 0 C--N 1.331 -0.236 0 N-CA-C 113.258 0.836 . . . . 0.0 113.258 -179.14 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 72.1 mmtt -98.47 -41.31 7.84 Favored 'General case' 0 CA--C 1.534 0.329 0 CA-C-N 115.096 -0.956 . . . . 0.0 111.671 179.716 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.4 m -132.32 163.56 28.38 Favored 'General case' 0 N--CA 1.471 0.59 0 N-CA-C 112.314 0.487 . . . . 0.0 112.314 -178.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.75 -55.51 29.41 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.501 -0.772 . . . . 0.0 112.194 179.945 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.463 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 60.4 mp0 -52.18 -28.63 18.96 Favored 'General case' 0 N--CA 1.483 1.206 0 N-CA-C 112.503 0.557 . . . . 0.0 112.503 -179.733 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -80.38 -39.1 29.07 Favored 'General case' 0 C--O 1.243 0.762 0 N-CA-C 109.226 -0.657 . . . . 0.0 109.226 177.894 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.458 ' HA ' ' CE1' ' A' ' 43' ' ' PHE . 36.3 t -67.01 -24.06 65.98 Favored 'General case' 0 C--N 1.35 0.622 0 CA-C-N 115.44 -0.8 . . . . 0.0 110.661 177.691 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.462 ' O ' ' N ' ' A' ' 54' ' ' GLY . 94.8 mtp -81.29 -55.99 4.36 Favored 'General case' 0 C--N 1.348 0.541 0 N-CA-C 109.133 -0.692 . . . . 0.0 109.133 177.974 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.463 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 99.3 mtt180 -45.66 -37.4 5.69 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.823 0.449 . . . . 0.0 111.483 178.917 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.8 m -90.28 -58.53 2.47 Favored 'General case' 0 CA--C 1.547 0.854 0 O-C-N 123.483 0.489 . . . . 0.0 110.044 178.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.468 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -121.34 62.46 0.9 Allowed 'General case' 0 CA--C 1.539 0.553 0 N-CA-C 112.308 0.485 . . . . 0.0 112.308 -179.635 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.462 ' N ' ' O ' ' A' ' 50' ' ' MET . . . -96.92 -100.37 1.98 Allowed Glycine 0 C--N 1.336 0.537 0 C-N-CA 121.123 -0.561 . . . . 0.0 112.574 179.894 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -140.0 48.66 0.83 Allowed Glycine 0 C--N 1.338 0.651 0 C-N-CA 121.378 -0.439 . . . . 0.0 112.65 -179.996 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.265 0 C-N-CA 124.01 0.924 . . . . 0.0 112.341 -179.974 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 10.6 p-10 . . . . . 0 N--CA 1.489 1.495 0 CA-C-O 120.556 0.217 . . . . 0.0 111.402 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.45 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 3.0 p90 -118.66 -158.96 0.74 Allowed 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 115.891 -0.595 . . . . 0.0 111.115 179.998 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.43 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 56.0 m 73.03 -51.26 0.71 Allowed 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 124.346 1.058 . . . . 0.0 111.891 -179.362 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.52 HD13 ' HB2' ' A' ' 23' ' ' ALA . 4.4 mm? -80.11 -2.2 43.47 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 122.727 0.411 . . . . 0.0 111.892 179.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.3 mm-40 -94.1 155.21 40.31 Favored Pre-proline 0 CA--C 1.539 0.528 0 CA-C-N 116.236 -0.438 . . . . 0.0 110.721 179.444 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 20.1 Cg_exo -67.02 148.56 81.86 Favored 'Trans proline' 0 C--N 1.371 1.735 0 C-N-CA 122.826 2.351 . . . . 0.0 112.945 -179.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.511 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 38.3 Cg_endo -58.97 138.62 86.69 Favored 'Trans proline' 0 C--N 1.371 1.739 0 C-N-CA 123.624 2.882 . . . . 0.0 113.884 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.548 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 32.0 t80 -128.78 95.51 4.12 Favored 'General case' 0 CA--C 1.538 0.511 0 CA-C-N 115.657 -0.701 . . . . 0.0 110.238 -179.896 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.2 m -95.22 -70.8 0.7 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.563 -179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 105.2 160.23 23.39 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-O 119.288 -0.729 . . . . 0.0 112.141 -179.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.0 Cg_exo -74.99 64.21 6.03 Favored 'Trans proline' 0 C--N 1.369 1.644 0 C-N-CA 122.937 2.424 . . . . 0.0 112.753 -179.7 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 61.6 m -132.0 -65.25 0.75 Allowed 'General case' 0 CA--C 1.535 0.385 0 CA-C-N 115.622 -0.717 . . . . 0.0 110.756 179.958 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 11.5 mptt 53.07 87.1 0.04 OUTLIER 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 124.078 0.951 . . . . 0.0 112.342 179.405 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.519 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -87.28 48.92 1.72 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-N 115.405 -0.816 . . . . 0.0 112.255 -179.231 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.519 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.2 OUTLIER 43.05 36.55 0.95 Allowed 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 114.387 1.255 . . . . 0.0 114.387 178.87 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.468 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 38.1 mt -132.35 141.64 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.437 0 CA-C-N 116.232 -0.44 . . . . 0.0 109.966 179.626 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.817 HG13 HG22 ' A' ' 32' ' ' VAL . 5.0 mp -117.85 103.33 14.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.613 0 CA-C-O 122.159 0.981 . . . . 0.0 108.513 179.394 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.607 ' N ' ' O ' ' A' ' 31' ' ' PHE . 19.2 mtt180 -90.77 -169.04 2.24 Favored 'General case' 0 C--N 1.318 -0.772 0 CA-C-N 113.106 -1.861 . . . . 0.0 111.404 -179.346 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.491 ' CE2' ' HB2' ' A' ' 46' ' ' ALA . 10.6 m-85 -124.84 158.96 32.16 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 122.334 0.254 . . . . 0.0 110.898 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.541 ' O ' ' HA ' ' A' ' 28' ' ' CYS . 7.6 p90 -157.48 169.13 25.41 Favored 'General case' 0 N--CA 1.478 0.933 0 N-CA-C 109.639 -0.504 . . . . 0.0 109.639 177.847 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.727 ' HB2' ' SG ' ' A' ' 53' ' ' CYS . 64.6 t80 -94.74 116.51 28.83 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-O 120.797 0.332 . . . . 0.0 110.955 179.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.595 HD21 ' HB2' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -98.69 83.68 3.01 Favored 'General case' 0 N--CA 1.445 -0.695 0 CA-C-N 115.598 -0.728 . . . . 0.0 109.542 179.443 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.52 ' HB2' HD13 ' A' ' 4' ' ' LEU . . . -55.68 -3.31 0.07 Allowed 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 113.136 0.791 . . . . 0.0 113.136 -179.082 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -96.48 -29.73 13.74 Favored 'General case' 0 CA--C 1.537 0.471 0 N-CA-C 109.829 -0.434 . . . . 0.0 109.829 178.447 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . 0.46 ' HB3' ' HB2' ' A' ' 22' ' ' ASN . . . -89.96 -33.4 16.4 Favored 'General case' 0 C--O 1.235 0.339 0 CA-C-N 115.659 -0.701 . . . . 0.0 111.85 179.923 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 116.21 -15.9 15.4 Favored Glycine 0 C--N 1.344 0.984 0 C-N-CA 121.055 -0.593 . . . . 0.0 114.274 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.5 pp -154.26 -169.71 3.32 Favored 'General case' 0 N--CA 1.478 0.952 0 CA-C-N 117.436 0.618 . . . . 0.0 111.737 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.541 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 58.8 m -81.7 139.82 34.68 Favored 'General case' 0 C--N 1.35 0.614 0 C-N-CA 122.867 0.467 . . . . 0.0 111.088 179.655 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.595 ' HB2' HD21 ' A' ' 22' ' ' ASN . 70.1 mt-30 -131.45 157.74 42.68 Favored 'General case' 0 C--O 1.241 0.626 0 CA-C-O 121.47 0.652 . . . . 0.0 112.653 -179.752 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 35.2 p -77.81 130.14 36.32 Favored 'General case' 0 N--CA 1.472 0.645 0 CA-C-N 113.382 -1.735 . . . . 0.0 111.766 -178.677 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.607 ' O ' ' N ' ' A' ' 18' ' ' ARG . 5.9 p90 -150.93 151.59 32.37 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.362 -0.836 . . . . 0.0 110.299 -179.789 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.817 HG22 HG13 ' A' ' 17' ' ' ILE . 20.7 t -76.59 125.19 36.13 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.534 0 C-N-CA 123.833 0.853 . . . . 0.0 110.922 -179.669 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.557 ' CG ' ' HD2' ' A' ' 18' ' ' ARG . 51.8 t80 -103.32 155.27 18.59 Favored 'General case' 0 C--O 1.236 0.36 0 CA-C-N 115.522 -0.763 . . . . 0.0 109.995 179.62 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.467 ' HA2' ' H ' ' A' ' 14' ' ' ALA . . . -105.8 -58.62 0.63 Allowed Glycine 0 C--N 1.336 0.566 0 CA-C-N 115.936 -0.575 . . . . 0.0 112.496 179.868 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . 87.33 17.95 58.05 Favored Glycine 0 C--N 1.339 0.704 0 C-N-CA 121.473 -0.394 . . . . 0.0 113.004 -179.81 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 25.5 p -95.05 -38.39 10.66 Favored 'General case' 0 C--O 1.234 0.262 0 C-N-CA 122.565 0.346 . . . . 0.0 111.245 -179.876 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.409 ' HD3' ' OH ' ' A' ' 8' ' ' TYR . 59.9 ttt180 -126.92 29.68 5.6 Favored 'General case' 0 CA--C 1.544 0.738 0 O-C-N 123.411 0.444 . . . . 0.0 110.581 179.753 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -18.61 130.66 0.01 OUTLIER 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 115.036 1.495 . . . . 0.0 115.036 -179.54 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.548 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 17.3 tptm -108.32 -132.57 0.32 Allowed 'General case' 0 CA--C 1.542 0.648 0 CA-C-N 115.389 -0.823 . . . . 0.0 109.424 179.782 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 87.3 mtm180 -123.35 -54.61 1.78 Allowed 'General case' 0 N--CA 1.467 0.395 0 N-CA-C 110.021 -0.363 . . . . 0.0 110.021 178.977 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.578 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.2 OUTLIER -66.54 80.22 0.1 Allowed 'General case' 0 N--CA 1.473 0.717 0 CA-C-O 121.247 0.546 . . . . 0.0 111.372 -179.47 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.468 ' ND2' ' HZ ' ' A' ' 31' ' ' PHE . 10.2 m120 -157.69 142.88 16.9 Favored 'General case' 0 C--O 1.235 0.325 0 CA-C-N 115.24 -0.891 . . . . 0.0 109.238 178.536 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . . . . . . . . . 61.3 m-85 -133.41 154.18 50.98 Favored 'General case' 0 C--N 1.328 -0.34 0 CA-C-N 115.892 -0.595 . . . . 0.0 110.963 -179.926 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -97.65 -46.94 5.81 Favored 'General case' 0 CA--C 1.534 0.36 0 CA-C-N 116.042 -0.526 . . . . 0.0 111.04 179.809 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 25.7 t -112.95 150.48 31.79 Favored 'General case' 0 C--O 1.241 0.625 0 O-C-N 123.486 0.492 . . . . 0.0 111.509 -179.154 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.491 ' HB2' ' CE2' ' A' ' 19' ' ' TYR . . . -68.04 -38.19 82.21 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-N 115.224 -0.898 . . . . 0.0 111.819 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.409 ' O ' ' HG3' ' A' ' 51' ' ' ARG . 67.4 tt0 -57.25 -42.94 82.48 Favored 'General case' 0 N--CA 1.474 0.752 0 O-C-N 123.499 0.499 . . . . 0.0 110.998 179.615 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.1 m-20 -70.6 -54.74 10.85 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 116.273 -0.421 . . . . 0.0 110.203 178.651 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 14.1 t -54.64 -29.69 53.05 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.463 0.477 . . . . 0.0 111.992 179.679 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.559 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 53.0 mtt -77.9 -47.96 17.48 Favored 'General case' 0 C--O 1.24 0.558 0 C-N-CA 122.819 0.448 . . . . 0.0 111.105 178.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.409 ' HG3' ' O ' ' A' ' 47' ' ' GLU . 99.4 mtt180 -59.82 -30.88 69.23 Favored 'General case' 0 N--CA 1.476 0.867 0 O-C-N 123.398 0.436 . . . . 0.0 111.675 179.198 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.7 m -89.24 -55.81 3.52 Favored 'General case' 0 CA--C 1.541 0.625 0 N-CA-C 109.595 -0.52 . . . . 0.0 109.595 179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.727 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 2.7 p -138.98 68.58 1.38 Allowed 'General case' 0 CA--C 1.537 0.464 0 CA-C-O 121.015 0.436 . . . . 0.0 111.593 179.688 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.559 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . -118.16 55.61 0.58 Allowed Glycine 0 C--N 1.339 0.727 0 C-N-CA 121.086 -0.578 . . . . 0.0 112.466 179.986 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 120.15 -39.52 2.44 Favored Glycine 0 C--N 1.337 0.604 0 C-N-CA 121.332 -0.461 . . . . 0.0 112.931 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.025 0 CA-C-O 118.28 -0.867 . . . . 0.0 111.118 179.995 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.0 m-20 . . . . . 0 N--CA 1.488 1.455 0 CA-C-O 120.519 0.199 . . . . 0.0 111.12 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.844 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 6.5 p90 -95.78 5.87 50.28 Favored 'General case' 0 CA--C 1.54 0.565 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.977 179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 49.6 t -86.16 -11.26 53.04 Favored 'General case' 0 N--CA 1.469 0.503 0 C-N-CA 122.797 0.439 . . . . 0.0 111.289 179.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.756 ' HA ' ' HB2' ' A' ' 23' ' ' ALA . 50.9 mt -125.08 -4.01 7.5 Favored 'General case' 0 CA--C 1.537 0.449 0 CA-C-N 116.077 -0.511 . . . . 0.0 111.821 179.966 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -93.77 146.92 32.63 Favored Pre-proline 0 CA--C 1.537 0.481 0 CA-C-N 116.656 -0.247 . . . . 0.0 111.464 -179.82 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 5.0 Cg_exo -78.76 162.81 26.75 Favored 'Trans proline' 0 C--N 1.371 1.739 0 C-N-CA 123.327 2.685 . . . . 0.0 112.915 -179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.622 ' HD3' ' HE2' ' A' ' 20' ' ' PHE . 66.8 Cg_endo -66.35 159.75 48.68 Favored 'Trans proline' 0 C--N 1.374 1.895 0 C-N-CA 123.202 2.601 . . . . 0.0 113.727 -179.685 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.51 ' HB3' ' HG2' ' A' ' 39' ' ' LYS . 54.0 t80 -137.17 83.85 2.02 Favored 'General case' 0 CA--C 1.54 0.572 0 CA-C-N 115.823 -0.626 . . . . 0.0 110.573 -179.96 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 10.6 m -95.86 -55.88 2.85 Favored 'General case' 0 CA--C 1.539 0.524 0 CA-C-N 115.944 -0.571 . . . . 0.0 110.232 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 87.89 -159.07 29.97 Favored Glycine 0 CA--C 1.53 1.01 0 CA-C-O 119.303 -0.721 . . . . 0.0 112.731 -179.852 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 4.1 Cg_exo -75.48 -1.1 10.9 Favored 'Trans proline' 0 C--N 1.37 1.71 0 C-N-CA 123.017 2.478 . . . . 0.0 113.058 179.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.1 OUTLIER -92.13 142.9 26.99 Favored 'General case' 0 C--O 1.234 0.266 0 CA-C-N 116.145 -0.48 . . . . 0.0 111.634 179.674 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 59.0 mttp -140.32 89.85 2.32 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.31 -0.859 . . . . 0.0 109.7 -179.431 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.498 ' O ' HG11 ' A' ' 32' ' ' VAL . . . -78.03 176.1 9.48 Favored 'General case' 0 CA--C 1.54 0.574 0 CA-C-N 114.616 -1.174 . . . . 0.0 111.824 -179.171 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.503 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 0.1 OUTLIER -105.1 25.98 9.88 Favored 'General case' 0 N--CA 1.471 0.609 0 CA-C-O 121.16 0.505 . . . . 0.0 111.823 -179.045 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 12.2 mt -127.66 86.76 1.03 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.541 0 CA-C-N 115.647 -0.706 . . . . 0.0 110.571 -179.065 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 1.011 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.6 mp -82.74 145.0 9.15 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.843 0 CA-C-O 121.423 0.63 . . . . 0.0 109.798 179.828 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.483 HH21 ' HB3' ' A' ' 33' ' ' TYR . 5.8 ttm-85 -139.6 -161.46 1.19 Allowed 'General case' 0 CA--C 1.539 0.53 0 CA-C-N 114.22 -1.355 . . . . 0.0 110.395 -177.704 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.471 ' CE1' HG22 ' A' ' 30' ' ' THR . 3.9 m-85 -119.24 165.6 14.03 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-O 120.626 0.25 . . . . 0.0 111.52 -179.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.622 ' HE2' ' HD3' ' A' ' 7' ' ' PRO . 1.6 p90 -166.08 -178.27 4.57 Favored 'General case' 0 N--CA 1.475 0.799 0 CA-C-N 115.474 -0.785 . . . . 0.0 110.397 176.556 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.533 ' HE2' ' SD ' ' A' ' 50' ' ' MET . 34.7 t80 -125.27 130.12 51.41 Favored 'General case' 0 N--CA 1.471 0.601 0 N-CA-C 110.108 -0.33 . . . . 0.0 110.108 179.479 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 65.7 m-80 -106.52 125.46 51.03 Favored 'General case' 0 C--O 1.239 0.529 0 CA-C-O 120.621 0.248 . . . . 0.0 110.983 179.46 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.756 ' HB2' ' HA ' ' A' ' 4' ' ' LEU . . . -82.42 15.27 2.57 Favored 'General case' 0 CA--C 1.541 0.627 0 CA-C-N 116.058 -0.519 . . . . 0.0 111.208 178.633 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 24.3 tptp -97.18 -39.92 9.05 Favored 'General case' 0 C--N 1.345 0.398 0 CA-C-N 115.875 -0.602 . . . . 0.0 109.503 178.485 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -102.62 -32.46 9.88 Favored 'General case' 0 C--O 1.235 0.327 0 CA-C-N 115.043 -0.98 . . . . 0.0 110.999 179.684 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 97.18 9.58 55.51 Favored Glycine 0 C--N 1.34 0.797 0 CA-C-N 115.904 -0.589 . . . . 0.0 114.088 179.161 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.9 ' HG ' HE22 ' A' ' 29' ' ' GLN . 0.6 OUTLIER -132.93 173.89 10.92 Favored 'General case' 0 C--O 1.239 0.536 0 CA-C-N 117.292 0.546 . . . . 0.0 111.479 -179.923 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.501 ' SG ' ' HD2' ' A' ' 21' ' ' TYR . 72.8 m -90.2 133.64 34.78 Favored 'General case' 0 C--N 1.345 0.394 0 CA-C-N 115.756 -0.656 . . . . 0.0 111.775 -179.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.9 HE22 ' HG ' ' A' ' 27' ' ' LEU . 12.6 mp0 -112.92 -162.36 0.8 Allowed 'General case' 0 C--O 1.242 0.661 0 CA-C-N 115.336 -0.847 . . . . 0.0 111.706 -179.13 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.471 HG22 ' CE1' ' A' ' 19' ' ' TYR . 41.3 p -131.26 126.75 36.25 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.242 0.617 . . . . 0.0 109.741 178.932 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.541 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 2.5 p90 -145.19 149.18 34.49 Favored 'General case' 0 CA--C 1.539 0.536 0 CA-C-N 116.364 -0.38 . . . . 0.0 111.586 -178.78 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 1.011 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.7 t -73.89 179.9 0.41 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.903 0 C-N-CA 124.462 1.105 . . . . 0.0 112.251 -176.885 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.725 ' H ' HG12 ' A' ' 32' ' ' VAL . 50.8 t80 -158.54 135.24 9.57 Favored 'General case' 0 N--CA 1.467 0.393 0 C-N-CA 123.784 0.834 . . . . 0.0 109.334 -179.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -141.3 -174.27 14.18 Favored Glycine 0 C--N 1.336 0.529 0 C-N-CA 121.113 -0.565 . . . . 0.0 112.838 179.989 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -89.56 8.51 79.68 Favored Glycine 0 C--N 1.339 0.721 0 C-N-CA 121.535 -0.364 . . . . 0.0 113.029 179.772 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.452 ' HB2' ' HD2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -95.11 -52.07 4.37 Favored 'General case' 0 C--O 1.234 0.269 0 C-N-CA 122.724 0.409 . . . . 0.0 111.88 179.758 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.452 ' HD2' ' HB2' ' A' ' 36' ' ' CYS . 1.3 mpt_? -132.24 110.48 10.65 Favored 'General case' 0 C--O 1.237 0.4 0 CA-C-O 121.05 0.452 . . . . 0.0 111.321 179.381 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -101.08 140.92 34.71 Favored 'General case' 0 C--O 1.234 0.241 0 CA-C-N 115.293 -0.867 . . . . 0.0 110.801 -179.988 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.51 ' HG2' ' HB3' ' A' ' 8' ' ' TYR . 6.9 mmtt -115.02 -162.18 0.81 Allowed 'General case' 0 CA--C 1.534 0.341 0 O-C-N 123.46 0.475 . . . . 0.0 110.777 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 40.2 mmt180 -125.16 3.54 7.89 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 116.208 -0.451 . . . . 0.0 111.863 -179.667 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.844 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -119.55 100.39 7.25 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-O 121.03 0.443 . . . . 0.0 110.162 179.104 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . . . . . . . . . 5.3 m120 -134.68 132.2 38.62 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.13 -0.941 . . . . 0.0 110.824 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.486 ' CD1' ' HA ' ' A' ' 49' ' ' CYS . 55.0 m-85 -142.53 164.72 29.36 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.815 -0.63 . . . . 0.0 111.004 179.134 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -99.54 -44.84 6.01 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 122.166 0.186 . . . . 0.0 110.89 179.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -136.4 161.41 35.89 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 116.186 -0.461 . . . . 0.0 111.652 -178.985 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -61.72 -25.72 67.61 Favored 'General case' 0 N--CA 1.473 0.719 0 CA-C-N 115.596 -0.729 . . . . 0.0 112.647 179.915 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.9 tt0 -59.72 -70.6 0.16 Allowed 'General case' 0 N--CA 1.474 0.742 0 O-C-N 123.413 0.445 . . . . 0.0 109.849 179.604 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -58.98 -40.16 84.0 Favored 'General case' 0 CA--C 1.541 0.608 0 C-N-CA 122.88 0.472 . . . . 0.0 110.46 178.965 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.486 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 49.7 t -52.58 -58.16 7.69 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.758 0.661 . . . . 0.0 111.559 179.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.533 ' SD ' ' HE2' ' A' ' 21' ' ' TYR . 5.5 mmt -64.54 -42.24 95.85 Favored 'General case' 0 CA--C 1.536 0.431 0 N-CA-C 112.897 0.703 . . . . 0.0 112.897 179.888 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 13.7 tpp85 -70.25 -24.95 63.16 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -178.732 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 32.2 m -90.46 -40.63 11.91 Favored 'General case' 0 N--CA 1.468 0.474 0 O-C-N 122.995 0.185 . . . . 0.0 111.392 -179.627 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -86.9 -55.09 4.0 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 110.239 -0.282 . . . . 0.0 110.239 179.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -98.75 51.37 1.19 Allowed Glycine 0 C--N 1.342 0.902 0 C-N-CA 121.307 -0.473 . . . . 0.0 112.625 -179.954 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -164.9 63.18 0.23 Allowed Glycine 0 C--N 1.338 0.641 0 C-N-CA 121.485 -0.388 . . . . 0.0 112.504 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.063 0 CA-C-O 118.21 -0.9 . . . . 0.0 111.061 -179.962 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 120.497 0.189 . . . . 0.0 111.163 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.602 ' H ' ' HD1' ' A' ' 2' ' ' PHE . 0.0 OUTLIER -130.84 -20.08 2.86 Favored 'General case' 0 CA--C 1.538 0.492 0 CA-C-N 115.955 -0.566 . . . . 0.0 111.848 -179.988 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 53' ' ' CYS . 18.7 m -71.21 -42.76 68.56 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 122.832 0.453 . . . . 0.0 112.14 179.841 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 6.3 mp -79.86 -7.89 58.98 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 116.136 -0.484 . . . . 0.0 112.172 -179.636 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 97.2 mt-10 -92.74 153.32 42.24 Favored Pre-proline 0 CA--C 1.538 0.518 0 CA-C-N 116.525 -0.307 . . . . 0.0 110.939 179.712 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_endo -64.08 139.66 68.09 Favored 'Trans proline' 0 C--N 1.372 1.809 0 C-N-CA 122.705 2.27 . . . . 0.0 113.282 -179.586 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.611 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 37.6 Cg_endo -58.43 136.46 74.46 Favored 'Trans proline' 0 C--N 1.371 1.718 0 C-N-CA 123.555 2.836 . . . . 0.0 114.197 -179.626 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 35.8 t80 -99.45 89.12 4.07 Favored 'General case' 0 C--O 1.239 0.535 0 CA-C-N 115.809 -0.632 . . . . 0.0 110.217 179.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 18.5 m -96.43 -63.37 1.15 Allowed 'General case' 0 CA--C 1.539 0.554 0 CA-C-N 115.603 -0.726 . . . . 0.0 110.458 179.814 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.574 ' HA3' ' HD2' ' A' ' 37' ' ' ARG . . . 84.76 -174.93 50.29 Favored Glycine 0 CA--C 1.532 1.155 0 CA-C-O 119.251 -0.749 . . . . 0.0 112.338 -179.304 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.584 ' HD2' ' HE ' ' A' ' 37' ' ' ARG . 3.4 Cg_exo -76.95 17.88 0.8 Allowed 'Trans proline' 0 C--N 1.37 1.697 0 C-N-CA 122.946 2.431 . . . . 0.0 113.141 179.696 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -118.74 132.48 56.15 Favored 'General case' 0 C--O 1.235 0.291 0 CA-C-N 116.167 -0.47 . . . . 0.0 111.651 179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 10.1 mptt -139.02 86.21 2.12 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 115.214 -0.903 . . . . 0.0 109.243 -179.942 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.494 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -80.32 52.99 1.69 Allowed 'General case' 0 CA--C 1.544 0.731 0 CA-C-N 114.973 -1.012 . . . . 0.0 112.456 -179.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.494 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.4 OUTLIER 42.13 36.2 0.67 Allowed 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 114.587 1.329 . . . . 0.0 114.587 178.903 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.599 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 37.6 mt -136.46 121.6 26.95 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.547 0 CA-C-N 116.264 -0.426 . . . . 0.0 109.86 179.415 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.765 HG13 HG22 ' A' ' 32' ' ' VAL . 4.4 mp -121.91 106.36 17.91 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.605 0 CA-C-O 122.177 0.989 . . . . 0.0 108.799 179.702 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.66 ' HG2' ' HG2' ' A' ' 44' ' ' LYS . 33.0 mtp180 -81.88 -160.07 0.33 Allowed 'General case' 0 CA--C 1.544 0.737 0 CA-C-N 113.227 -1.806 . . . . 0.0 111.178 -179.878 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.561 ' HA ' ' HA ' ' A' ' 30' ' ' THR . 15.7 m-85 -129.81 113.5 14.77 Favored 'General case' 0 N--CA 1.475 0.808 0 N-CA-C 113.546 0.943 . . . . 0.0 113.546 -178.907 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.573 ' HA ' ' CB ' ' A' ' 42' ' ' ASN . 4.8 p90 -106.87 -174.59 2.57 Favored 'General case' 0 CA--C 1.545 0.787 0 CA-C-N 115.921 -0.582 . . . . 0.0 110.644 -179.81 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . . . . . . . . . 60.8 t80 -128.42 134.72 48.85 Favored 'General case' 0 N--CA 1.468 0.441 0 CA-C-O 120.326 0.107 . . . . 0.0 110.924 -179.931 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -106.57 107.4 18.39 Favored 'General case' 0 N--CA 1.45 -0.453 0 N-CA-C 109.118 -0.697 . . . . 0.0 109.118 178.343 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -67.29 -2.73 6.43 Favored 'General case' 0 CA--C 1.54 0.596 0 N-CA-C 112.959 0.726 . . . . 0.0 112.959 -179.154 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -96.38 -34.4 11.56 Favored 'General case' 0 N--CA 1.467 0.409 0 CA-C-O 120.598 0.237 . . . . 0.0 110.588 -179.946 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -92.18 -41.76 10.26 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.641 -0.709 . . . . 0.0 112.0 -179.482 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 90.08 52.04 2.66 Favored Glycine 0 C--N 1.342 0.865 0 N-CA-C 111.507 -0.637 . . . . 0.0 111.507 -178.948 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.2 pp -166.35 162.14 16.96 Favored 'General case' 0 C--O 1.243 0.716 0 C-N-CA 123.108 0.563 . . . . 0.0 111.159 -179.884 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 43.0 m -94.91 111.49 23.28 Favored 'General case' 0 C--O 1.236 0.383 0 CA-C-N 115.74 -0.664 . . . . 0.0 110.746 179.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.555 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 16.8 tp60 -87.73 -163.74 0.99 Allowed 'General case' 0 CA--C 1.543 0.678 0 CA-C-N 115.356 -0.838 . . . . 0.0 110.461 -179.065 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.672 ' HB ' HG22 ' A' ' 17' ' ' ILE . 33.6 p -129.4 133.37 47.33 Favored 'General case' 0 CA--C 1.516 -0.334 0 N-CA-C 108.87 -0.789 . . . . 0.0 108.87 178.162 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.64 ' O ' ' N ' ' A' ' 18' ' ' ARG . 14.3 p90 -133.97 148.24 51.13 Favored 'General case' 0 CA--C 1.54 0.575 0 CA-C-O 120.893 0.378 . . . . 0.0 111.569 -178.192 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.765 HG22 HG13 ' A' ' 17' ' ' ILE . 10.9 t -77.06 125.79 37.16 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.544 0 C-N-CA 123.933 0.893 . . . . 0.0 111.791 -178.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.642 ' HE1' ' H ' ' A' ' 39' ' ' LYS . 77.5 t80 -126.53 129.16 48.08 Favored 'General case' 0 C--O 1.235 0.322 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.108 179.409 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.427 ' HA2' ' HB3' ' A' ' 14' ' ' ALA . . . -128.04 -170.82 12.89 Favored Glycine 0 C--N 1.336 0.547 0 C-N-CA 121.059 -0.591 . . . . 0.0 113.274 -179.596 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -87.98 -9.64 70.55 Favored Glycine 0 C--N 1.341 0.811 0 O-C-N 123.735 0.314 . . . . 0.0 112.947 179.894 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -82.72 -34.67 27.18 Favored 'General case' 0 N--CA 1.468 0.458 0 C-N-CA 122.789 0.436 . . . . 0.0 112.143 179.404 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.584 ' HE ' ' HD2' ' A' ' 11' ' ' PRO . 84.0 mtt-85 -129.58 83.87 2.17 Favored 'General case' 0 C--O 1.238 0.496 0 CA-C-O 121.504 0.668 . . . . 0.0 110.383 179.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -93.09 117.63 30.29 Favored 'General case' 0 C--O 1.237 0.42 0 CA-C-N 115.0 -1.0 . . . . 0.0 111.511 -179.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.642 ' H ' ' HE1' ' A' ' 33' ' ' TYR . 7.4 mmtt -147.06 -174.83 4.6 Favored 'General case' 0 N--CA 1.467 0.419 0 CA-C-N 115.562 -0.744 . . . . 0.0 110.567 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 99.7 mtt180 -109.75 90.2 3.24 Favored 'General case' 0 C--O 1.237 0.447 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 177.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.611 ' ND2' ' HA ' ' A' ' 7' ' ' PRO . 0.6 OUTLIER -87.27 -68.63 0.74 Allowed 'General case' 0 C--O 1.233 0.234 0 CA-C-N 115.373 -0.83 . . . . 0.0 111.802 -178.265 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.573 ' CB ' ' HA ' ' A' ' 20' ' ' PHE . 9.1 t-20 -150.75 -94.55 0.06 Allowed 'General case' 0 N--CA 1.447 -0.586 0 N-CA-C 109.534 -0.543 . . . . 0.0 109.534 -179.996 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.488 ' CD1' ' HB3' ' A' ' 48' ' ' ASP . 66.9 m-85 -154.77 168.88 25.39 Favored 'General case' 0 C--N 1.349 0.56 0 N-CA-C 112.176 0.435 . . . . 0.0 112.176 -179.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.66 ' HG2' ' HG2' ' A' ' 18' ' ' ARG . 0.6 OUTLIER -95.66 -24.56 16.5 Favored 'General case' 0 CA--C 1.542 0.665 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.288 178.587 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.487 ' HB3' ' OD2' ' A' ' 48' ' ' ASP . 26.1 t -112.53 153.68 27.1 Favored 'General case' 0 C--O 1.239 0.546 0 CA-C-O 120.915 0.388 . . . . 0.0 111.665 -179.586 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -70.4 -49.63 46.97 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-N 115.522 -0.763 . . . . 0.0 112.442 -179.693 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 68.2 tt0 -56.32 -34.72 66.8 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.781 0.433 . . . . 0.0 111.151 -179.997 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.488 ' HB3' ' CD1' ' A' ' 43' ' ' PHE . 51.7 m-20 -72.7 -51.03 20.99 Favored 'General case' 0 C--O 1.242 0.71 0 CA-C-N 115.482 -0.781 . . . . 0.0 110.495 178.904 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.6 t -60.79 -30.81 70.27 Favored 'General case' 0 N--CA 1.472 0.64 0 CA-C-N 116.199 -0.455 . . . . 0.0 111.181 178.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 63.9 mtt -75.74 -49.38 18.4 Favored 'General case' 0 C--N 1.345 0.376 0 C-N-CA 123.022 0.529 . . . . 0.0 111.434 179.598 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.451 ' HG2' ' HA ' ' A' ' 48' ' ' ASP . 17.4 ptm180 -61.35 -28.01 68.91 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 111.995 0.369 . . . . 0.0 111.995 179.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 10.8 m -92.5 -61.99 1.49 Allowed 'General case' 0 CA--C 1.549 0.91 0 O-C-N 123.281 0.363 . . . . 0.0 111.681 -179.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.505 ' HB3' ' HB3' ' A' ' 3' ' ' CYS . 0.0 OUTLIER -92.32 -23.71 19.18 Favored 'General case' 0 C--N 1.346 0.429 0 N-CA-C 114.263 1.209 . . . . 0.0 114.263 -178.426 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -89.13 47.05 3.31 Favored Glycine 0 C--N 1.339 0.7 0 C-N-CA 120.837 -0.697 . . . . 0.0 113.043 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 173.19 -67.17 0.11 Allowed Glycine 0 C--N 1.338 0.687 0 C-N-CA 121.47 -0.395 . . . . 0.0 112.478 179.935 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.22 0 C-N-CA 124.036 0.934 . . . . 0.0 112.309 179.97 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 1.5 m-20 . . . . . 0 N--CA 1.49 1.538 0 CA-C-O 120.531 0.205 . . . . 0.0 111.08 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.2 OUTLIER -134.68 -21.26 1.73 Allowed 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 112.682 0.623 . . . . 0.0 112.682 -179.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 0.7 OUTLIER -89.29 -13.84 37.14 Favored 'General case' 0 N--CA 1.469 0.495 0 N-CA-C 112.265 0.469 . . . . 0.0 112.265 -178.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.744 HD23 ' HE2' ' A' ' 21' ' ' TYR . 75.2 mt -79.2 -8.5 59.06 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 111.819 0.303 . . . . 0.0 111.819 179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.4 mm-40 -95.56 153.92 39.37 Favored Pre-proline 0 CA--C 1.537 0.461 0 CA-C-N 116.186 -0.461 . . . . 0.0 110.845 179.665 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 22.4 Cg_exo -66.34 167.0 19.64 Favored 'Trans proline' 0 C--N 1.371 1.719 0 C-N-CA 123.058 2.506 . . . . 0.0 112.776 -179.88 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.525 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 55.8 Cg_endo -60.87 126.0 18.56 Favored 'Trans proline' 0 C--N 1.375 1.974 0 C-N-CA 123.151 2.568 . . . . 0.0 112.542 179.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.536 ' CZ ' ' HD3' ' A' ' 37' ' ' ARG . 6.6 t80 -94.01 7.24 45.84 Favored 'General case' 0 CA--C 1.543 0.687 0 N-CA-C 113.059 0.763 . . . . 0.0 113.059 -178.412 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.414 HG23 ' H ' ' A' ' 34' ' ' GLY . 7.3 m -55.79 -11.51 1.01 Allowed 'General case' 0 N--CA 1.484 1.244 0 O-C-N 122.272 -0.267 . . . . 0.0 111.615 179.15 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 53.14 -154.79 6.23 Favored Glycine 0 C--N 1.349 1.262 0 CA-C-N 115.581 -0.736 . . . . 0.0 113.177 178.718 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 3.9 Cg_endo -85.06 34.17 0.5 Allowed 'Trans proline' 0 C--N 1.367 1.505 0 C-N-CA 123.004 2.469 . . . . 0.0 112.292 178.94 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 34.5 m -87.56 -66.68 0.89 Allowed 'General case' 0 CA--C 1.537 0.471 0 CA-C-N 115.821 -0.627 . . . . 0.0 111.785 -179.078 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER 64.9 96.4 0.05 OUTLIER 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.847 0.859 . . . . 0.0 111.701 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.473 ' HB2' ' HA2' ' A' ' 34' ' ' GLY . . . -91.51 -141.1 0.18 Allowed 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 115.26 -0.882 . . . . 0.0 111.185 -179.585 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.523 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 2.4 ppt_? -135.21 24.28 3.52 Favored 'General case' 0 N--CA 1.474 0.745 0 CA-C-O 121.163 0.506 . . . . 0.0 111.748 -179.69 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.492 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 33.0 mt -132.56 102.47 5.36 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.519 0 CA-C-N 115.523 -0.762 . . . . 0.0 110.29 -179.179 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.944 HG13 HG22 ' A' ' 32' ' ' VAL . 3.2 mp -91.12 150.39 3.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.883 0 CA-C-O 121.368 0.604 . . . . 0.0 109.596 179.536 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.82 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 17.1 mtt180 -145.21 -158.89 0.93 Allowed 'General case' 0 CA--C 1.539 0.533 0 CA-C-N 114.507 -1.224 . . . . 0.0 109.666 -178.492 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.608 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 5.7 m-85 -124.8 115.27 20.42 Favored 'General case' 0 C--O 1.247 0.95 0 N-CA-C 113.986 1.106 . . . . 0.0 113.986 -179.008 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.608 ' HB3' ' CD1' ' A' ' 31' ' ' PHE . 9.3 p90 -106.83 -167.65 1.31 Allowed 'General case' 0 CA--C 1.553 1.063 0 O-C-N 123.911 0.757 . . . . 0.0 109.565 179.233 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.744 ' HE2' HD23 ' A' ' 4' ' ' LEU . 0.8 OUTLIER -140.44 128.25 21.84 Favored 'General case' 0 N--CA 1.47 0.558 0 O-C-N 121.979 -0.451 . . . . 0.0 110.964 179.395 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 71.1 m-80 -93.9 116.87 29.35 Favored 'General case' 0 C--O 1.239 0.545 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 177.596 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.41 13.49 2.42 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-O 120.952 0.406 . . . . 0.0 111.31 179.846 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 72.2 mmtt -97.04 -33.2 11.63 Favored 'General case' 0 C--N 1.345 0.412 0 CA-C-N 115.775 -0.648 . . . . 0.0 109.873 178.251 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -109.39 -47.49 3.38 Favored 'General case' 0 C--O 1.234 0.277 0 CA-C-N 115.139 -0.937 . . . . 0.0 111.157 179.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 127.08 -39.95 1.86 Allowed Glycine 0 C--N 1.345 1.043 0 C-N-CA 121.368 -0.444 . . . . 0.0 112.467 -179.688 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.6 pp -70.88 158.56 36.2 Favored 'General case' 0 C--O 1.248 0.976 0 N-CA-C 114.035 1.124 . . . . 0.0 114.035 -178.082 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.527 ' SG ' ' O ' ' A' ' 20' ' ' PHE . 35.9 t -97.49 118.86 34.93 Favored 'General case' 0 C--O 1.236 0.366 0 CA-C-N 114.032 -1.44 . . . . 0.0 109.047 178.769 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.433 ' O ' ' HA ' ' A' ' 19' ' ' TYR . 0.1 OUTLIER -104.78 -162.4 0.88 Allowed 'General case' 0 N--CA 1.466 0.329 0 O-C-N 122.989 0.181 . . . . 0.0 111.267 -177.565 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.603 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 37.3 p -114.38 154.81 27.42 Favored 'General case' 0 C--N 1.344 0.35 0 N-CA-C 109.912 -0.403 . . . . 0.0 109.912 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.608 ' CD1' ' HB3' ' A' ' 20' ' ' PHE . 4.7 p90 -160.75 151.39 18.34 Favored 'General case' 0 N--CA 1.467 0.41 0 CA-C-O 120.788 0.328 . . . . 0.0 110.796 -179.817 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.944 HG22 HG13 ' A' ' 17' ' ' ILE . 5.8 t -87.07 136.49 22.86 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 115.777 -0.647 . . . . 0.0 110.31 179.112 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.43 ' OH ' ' HB1' ' A' ' 38' ' ' ALA . 44.0 t80 -102.18 111.27 23.48 Favored 'General case' 0 C--O 1.236 0.391 0 CA-C-N 115.622 -0.717 . . . . 0.0 109.701 179.854 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.473 ' HA2' ' HB2' ' A' ' 14' ' ' ALA . . . -100.06 151.55 19.18 Favored Glycine 0 C--N 1.336 0.551 0 CA-C-N 115.824 -0.625 . . . . 0.0 112.661 -179.462 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -92.29 34.17 4.57 Favored Glycine 0 C--N 1.338 0.663 0 C-N-CA 121.511 -0.375 . . . . 0.0 112.739 179.672 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 30.5 p -95.26 -39.9 9.83 Favored 'General case' 0 C--O 1.235 0.295 0 C-N-CA 122.47 0.308 . . . . 0.0 111.15 179.869 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.536 ' HD3' ' CZ ' ' A' ' 8' ' ' TYR . 88.2 mtt-85 -129.51 -50.16 1.17 Allowed 'General case' 0 N--CA 1.466 0.342 0 O-C-N 123.467 0.48 . . . . 0.0 110.81 179.901 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . 0.43 ' HB1' ' OH ' ' A' ' 33' ' ' TYR . . . 60.18 136.38 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 124.111 0.964 . . . . 0.0 113.137 179.27 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 6.9 mmtt -138.23 -170.77 2.88 Favored 'General case' 0 N--CA 1.468 0.437 0 CA-C-N 115.886 -0.597 . . . . 0.0 111.397 179.505 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 80.1 mtp180 -104.55 52.07 0.76 Allowed 'General case' 0 N--CA 1.469 0.512 0 CA-C-N 115.193 -0.912 . . . . 0.0 111.464 -179.242 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.521 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.3 OUTLIER -145.44 91.21 2.09 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-O 121.053 0.454 . . . . 0.0 110.727 179.125 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.82 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 7.5 m120 -153.68 131.5 11.62 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.633 -0.712 . . . . 0.0 111.117 178.702 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.608 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 35.5 m-85 -134.61 132.2 38.74 Favored 'General case' 0 N--CA 1.462 0.152 0 CA-C-N 116.218 -0.446 . . . . 0.0 111.834 178.501 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.758 ' HD3' ' HE ' ' A' ' 18' ' ' ARG . 3.6 mmmp? -95.48 -5.1 43.7 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 115.667 -0.697 . . . . 0.0 111.889 -179.493 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -137.79 143.25 40.99 Favored 'General case' 0 C--O 1.237 0.434 0 CA-C-N 116.475 -0.33 . . . . 0.0 111.104 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -66.24 -53.31 38.49 Favored 'General case' 0 CA--C 1.537 0.466 0 CA-C-N 115.776 -0.647 . . . . 0.0 111.658 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 27.4 tt0 -55.14 -39.16 69.13 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.265 0.626 . . . . 0.0 111.917 -179.62 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 6.1 t0 -74.34 -36.65 63.66 Favored 'General case' 0 C--O 1.243 0.724 0 N-CA-C 109.56 -0.533 . . . . 0.0 109.56 178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 35.1 t -64.29 -27.74 69.24 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 115.074 -0.967 . . . . 0.0 110.017 177.449 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 94.1 mtp -80.55 -48.56 12.55 Favored 'General case' 0 CA--C 1.534 0.349 0 CA-C-N 114.872 -1.058 . . . . 0.0 109.754 178.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -50.34 -38.65 43.15 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.128 0.571 . . . . 0.0 111.243 179.352 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.0 m -99.15 -54.72 2.89 Favored 'General case' 0 CA--C 1.544 0.745 0 O-C-N 123.308 0.38 . . . . 0.0 110.947 179.435 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -103.37 39.92 1.5 Allowed 'General case' 0 CA--C 1.546 0.791 0 N-CA-C 113.272 0.841 . . . . 0.0 113.272 -178.64 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -155.31 65.72 0.32 Allowed Glycine 0 C--N 1.332 0.308 0 CA-C-N 116.202 -0.453 . . . . 0.0 112.5 179.194 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -101.46 -83.69 1.75 Allowed Glycine 0 C--N 1.337 0.608 0 C-N-CA 121.495 -0.383 . . . . 0.0 112.469 179.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.032 0 CA-C-O 118.235 -0.888 . . . . 0.0 111.09 -179.941 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.742 ' HB3' ' HB2' ' A' ' 4' ' ' LEU . 54.0 m-20 . . . . . 0 N--CA 1.488 1.426 0 CA-C-O 120.488 0.185 . . . . 0.0 111.125 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.548 ' O ' ' HB2' ' A' ' 41' ' ' ASN . 24.8 p90 -123.39 -34.37 3.11 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.911 -0.586 . . . . 0.0 111.7 179.961 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 5.7 t -93.37 -9.25 39.4 Favored 'General case' 0 N--CA 1.469 0.497 0 O-C-N 123.407 0.442 . . . . 0.0 111.017 179.887 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.742 ' HB2' ' HB3' ' A' ' 1' ' ' ASP . 2.8 mm? -83.13 -7.43 59.63 Favored 'General case' 0 N--CA 1.473 0.694 0 CA-C-N 115.753 -0.658 . . . . 0.0 112.298 179.752 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 55.5 mm-40 -94.15 157.27 37.96 Favored Pre-proline 0 CA--C 1.541 0.599 0 C-N-CA 122.485 0.314 . . . . 0.0 111.244 -179.801 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_exo -62.9 171.51 5.92 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 122.943 2.429 . . . . 0.0 112.671 179.905 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.56 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 23.2 Cg_endo -53.01 133.88 53.63 Favored 'Trans proline' 0 C--N 1.381 2.241 0 C-N-CA 123.515 2.81 . . . . 0.0 113.298 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.622 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 60.4 t80 -122.55 54.06 1.22 Allowed 'General case' 0 CA--C 1.546 0.797 0 CA-C-N 116.14 -0.482 . . . . 0.0 112.261 -178.242 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.547 HG22 ' O ' ' A' ' 12' ' ' CYS . 20.4 m -96.08 12.59 30.08 Favored 'General case' 0 CA--C 1.542 0.647 0 N-CA-C 109.017 -0.734 . . . . 0.0 109.017 178.252 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 36.71 -143.75 0.14 Allowed Glycine 0 CA--C 1.537 1.407 0 CA-C-N 114.287 -1.324 . . . . 0.0 114.398 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 2.9 Cg_endo -81.13 1.8 9.04 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 123.111 2.541 . . . . 0.0 113.131 179.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.547 ' O ' HG22 ' A' ' 9' ' ' THR . 0.1 OUTLIER -98.12 149.11 22.86 Favored 'General case' 0 C--O 1.233 0.23 0 CA-C-N 116.149 -0.478 . . . . 0.0 111.879 -179.769 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 54.4 mttp -146.89 96.21 2.71 Favored 'General case' 0 C--O 1.238 0.481 0 C-N-CA 123.856 0.862 . . . . 0.0 109.381 -179.397 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.558 ' CB ' ' HA2' ' A' ' 34' ' ' GLY . . . -79.4 33.92 0.25 Allowed 'General case' 0 CA--C 1.547 0.846 0 CA-C-N 114.897 -1.047 . . . . 0.0 113.163 -178.908 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.606 ' O ' ' HD2' ' A' ' 15' ' ' ARG . 0.2 OUTLIER 44.9 26.83 0.23 Allowed 'General case' 0 N--CA 1.498 1.946 0 N-CA-C 114.757 1.391 . . . . 0.0 114.757 178.408 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 14' ' ' ALA . 28.4 mt -130.22 118.43 43.59 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.535 0 CA-C-N 116.369 -0.378 . . . . 0.0 110.31 -179.8 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 1.058 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 34.4 mt -81.07 139.24 18.35 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.881 0 CA-C-O 121.624 0.726 . . . . 0.0 110.288 179.602 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.85 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 3.8 ttt180 -131.93 -170.49 2.41 Favored 'General case' 0 CA--C 1.542 0.659 0 CA-C-N 113.796 -1.547 . . . . 0.0 110.927 -177.919 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.466 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 6.3 m-85 -126.3 154.06 43.97 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 122.487 0.315 . . . . 0.0 111.028 -179.901 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.643 ' HB3' ' CE1' ' A' ' 31' ' ' PHE . 10.3 p90 -144.75 158.6 43.72 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 109.825 -0.435 . . . . 0.0 109.825 178.376 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.428 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 12.3 t80 -90.87 120.34 31.81 Favored 'General case' 0 N--CA 1.472 0.655 0 N-CA-C 113.463 0.912 . . . . 0.0 113.463 -178.621 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 3.9 m120 -103.48 100.22 10.07 Favored 'General case' 0 C--O 1.244 0.811 0 N-CA-C 107.222 -1.399 . . . . 0.0 107.222 175.862 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -74.03 16.25 0.25 Allowed 'General case' 0 CA--C 1.544 0.724 0 N-CA-C 112.005 0.372 . . . . 0.0 112.005 -178.974 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 79.9 tttt -96.2 -26.16 15.55 Favored 'General case' 0 C--N 1.344 0.357 0 CA-C-N 116.217 -0.447 . . . . 0.0 109.873 178.899 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -116.79 -38.08 3.51 Favored 'General case' 0 C--O 1.235 0.313 0 CA-C-N 115.36 -0.837 . . . . 0.0 111.317 -179.908 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 104.82 31.35 4.52 Favored Glycine 0 C--N 1.343 0.919 0 C-N-CA 121.276 -0.488 . . . . 0.0 113.304 179.619 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.658 ' HA ' ' SD ' ' A' ' 50' ' ' MET . 0.5 OUTLIER -152.42 168.44 25.48 Favored 'General case' 0 N--CA 1.473 0.675 0 CA-C-O 120.896 0.379 . . . . 0.0 111.499 179.509 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.559 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 97.7 m -94.54 127.5 40.52 Favored 'General case' 0 C--O 1.235 0.301 0 CA-C-N 115.471 -0.786 . . . . 0.0 110.772 179.827 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.566 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 52.5 tp60 -94.74 159.13 15.2 Favored 'General case' 0 C--O 1.238 0.479 0 CA-C-N 115.685 -0.689 . . . . 0.0 111.074 -179.02 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 37.0 p -94.98 124.53 39.08 Favored 'General case' 0 N--CA 1.468 0.434 0 CA-C-N 115.275 -0.875 . . . . 0.0 111.666 -179.655 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.713 ' O ' ' N ' ' A' ' 18' ' ' ARG . 3.7 p90 -155.58 160.93 40.87 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.288 -0.869 . . . . 0.0 109.287 179.9 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 1.058 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 2.5 t -72.8 -179.02 0.33 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.061 0 C-N-CA 123.294 0.638 . . . . 0.0 111.87 -177.081 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.752 ' H ' HG12 ' A' ' 32' ' ' VAL . 48.7 t80 -148.71 155.76 41.45 Favored 'General case' 0 N--CA 1.466 0.338 0 CA-C-N 115.655 -0.702 . . . . 0.0 111.037 -178.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.558 ' HA2' ' CB ' ' A' ' 14' ' ' ALA . . . -142.95 140.52 9.82 Favored Glycine 0 C--N 1.335 0.526 0 CA-C-N 115.128 -0.942 . . . . 0.0 111.767 179.186 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -78.64 2.21 68.94 Favored Glycine 0 C--N 1.341 0.823 0 C-N-CA 121.523 -0.37 . . . . 0.0 113.036 179.792 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -95.56 -2.92 47.45 Favored 'General case' 0 CA--C 1.537 0.468 0 N-CA-C 113.071 0.767 . . . . 0.0 113.071 179.905 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 25.4 mmm180 -133.55 -13.33 2.62 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.459 0.54 . . . . 0.0 112.459 179.804 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -8.81 119.28 0.01 OUTLIER 'General case' 0 N--CA 1.492 1.649 0 C-N-CA 124.951 1.3 . . . . 0.0 114.389 -179.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.622 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 21.7 tptm -127.65 -108.88 0.29 Allowed 'General case' 0 CA--C 1.549 0.909 0 CA-C-N 115.949 -0.569 . . . . 0.0 111.828 -178.457 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 5.1 mmm180 -153.27 -32.35 0.12 Allowed 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.726 0.81 . . . . 0.0 111.684 -179.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.573 HD21 ' HB2' ' A' ' 20' ' ' PHE . 14.2 t30 -67.8 -2.56 7.38 Favored 'General case' 0 CA--C 1.547 0.855 0 C-N-CA 124.033 0.933 . . . . 0.0 113.396 -178.979 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.85 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 2.2 m120 -105.34 139.37 40.09 Favored 'General case' 0 C--N 1.328 -0.335 0 CA-C-O 120.868 0.366 . . . . 0.0 110.716 -178.793 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.445 ' C ' ' HG2' ' A' ' 18' ' ' ARG . 5.5 m-85 -151.96 126.26 9.32 Favored 'General case' 0 N--CA 1.465 0.297 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.154 -178.049 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.76 ' HD2' ' HE ' ' A' ' 18' ' ' ARG . 0.2 OUTLIER -65.06 -39.78 93.75 Favored 'General case' 0 N--CA 1.479 1.003 0 N-CA-C 112.427 0.529 . . . . 0.0 112.427 -179.774 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.7 m -99.67 128.73 45.77 Favored 'General case' 0 C--O 1.241 0.611 0 CA-C-O 120.987 0.422 . . . . 0.0 111.997 -179.057 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.15 -41.23 99.24 Favored 'General case' 0 N--CA 1.47 0.528 0 CA-C-N 115.423 -0.808 . . . . 0.0 110.993 178.852 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.444 ' O ' ' HB2' ' A' ' 51' ' ' ARG . 20.1 pt-20 -48.14 -55.91 9.14 Favored 'General case' 0 N--CA 1.476 0.866 0 O-C-N 123.917 0.76 . . . . 0.0 111.6 179.628 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 55.0 m-20 -66.67 -45.94 77.29 Favored 'General case' 0 N--CA 1.472 0.639 0 C-N-CA 122.457 0.303 . . . . 0.0 110.677 178.697 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 40.7 t -47.3 -51.91 17.8 Favored 'General case' 0 N--CA 1.477 0.916 0 O-C-N 123.809 0.693 . . . . 0.0 110.873 179.218 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.797 ' HA ' ' HE2' ' A' ' 50' ' ' MET . 8.5 mmt -74.79 -33.26 62.21 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 122.955 0.502 . . . . 0.0 111.573 178.677 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.444 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 67.0 ttt180 -60.13 -29.27 68.52 Favored 'General case' 0 N--CA 1.474 0.769 0 CA-C-N 116.446 -0.343 . . . . 0.0 111.163 179.357 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.4 m -101.55 -52.94 3.1 Favored 'General case' 0 CA--C 1.54 0.572 0 O-C-N 123.493 0.496 . . . . 0.0 110.824 179.891 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.428 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -102.7 28.8 5.78 Favored 'General case' 0 CA--C 1.545 0.752 0 N-CA-C 113.717 1.006 . . . . 0.0 113.717 -178.467 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -144.83 55.12 0.55 Allowed Glycine 0 N--CA 1.459 0.168 0 O-C-N 121.789 -0.569 . . . . 0.0 112.506 179.324 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 144.89 -66.14 0.44 Allowed Glycine 0 C--N 1.336 0.542 0 C-N-CA 121.47 -0.395 . . . . 0.0 112.499 -179.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.255 0 C-N-CA 124.018 0.927 . . . . 0.0 112.305 179.993 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 9.3 t70 . . . . . 0 N--CA 1.487 1.387 0 CA-C-O 120.517 0.199 . . . . 0.0 110.607 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.674 ' HB2' ' O ' ' A' ' 40' ' ' ARG . 4.3 p90 -128.28 -6.9 5.34 Favored 'General case' 0 CA--C 1.541 0.616 0 CA-C-N 115.916 -0.584 . . . . 0.0 111.784 -179.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.613 ' HB3' ' HB3' ' A' ' 21' ' ' TYR . 57.0 m -72.88 -50.99 20.43 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 112.815 0.672 . . . . 0.0 112.815 -178.969 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . . . . . . . . . 1.7 pp -84.16 43.53 0.95 Allowed 'General case' 0 CA--C 1.542 0.656 0 CA-C-O 121.427 0.632 . . . . 0.0 112.014 -179.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -127.17 153.77 76.79 Favored Pre-proline 0 CA--C 1.537 0.476 0 CA-C-N 115.334 -0.848 . . . . 0.0 110.446 179.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 32.5 Cg_endo -64.95 134.77 41.32 Favored 'Trans proline' 0 C--N 1.371 1.725 0 C-N-CA 122.549 2.166 . . . . 0.0 113.396 -179.601 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -57.87 141.02 95.71 Favored 'Trans proline' 0 C--N 1.372 1.776 0 C-N-CA 123.659 2.906 . . . . 0.0 113.86 -179.795 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 44.9 t80 -117.06 102.38 9.28 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.662 -0.699 . . . . 0.0 110.463 -179.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 26.0 m -95.93 -83.0 0.38 Allowed 'General case' 0 CA--C 1.542 0.637 0 CA-C-N 116.262 -0.426 . . . . 0.0 110.73 -179.875 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 108.14 137.64 8.29 Favored Glycine 0 C--N 1.341 0.824 0 CA-C-O 118.933 -0.926 . . . . 0.0 110.946 -178.399 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 20.2 Cg_exo -66.05 83.16 0.26 Allowed 'Trans proline' 0 C--N 1.37 1.685 0 C-N-CA 122.802 2.334 . . . . 0.0 112.847 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 83.6 m -138.2 -167.6 2.2 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.498 -0.773 . . . . 0.0 111.33 -179.416 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 63.6 mttp -99.7 72.5 1.75 Allowed 'General case' 0 C--O 1.238 0.476 0 CA-C-O 122.195 0.998 . . . . 0.0 108.834 179.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.55 ' O ' ' HG3' ' A' ' 15' ' ' ARG . . . -77.45 -55.63 5.22 Favored 'General case' 0 CA--C 1.535 0.369 0 CA-C-N 113.901 -1.5 . . . . 0.0 113.104 -177.886 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.55 ' HG3' ' O ' ' A' ' 14' ' ' ALA . 0.3 OUTLIER 46.95 22.39 0.2 Allowed 'General case' 0 N--CA 1.497 1.884 0 C-N-CA 124.523 1.129 . . . . 0.0 113.792 -179.57 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.563 ' O ' ' HA ' ' A' ' 32' ' ' VAL . 27.4 mt -135.76 142.02 40.39 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.529 0 CA-C-N 115.504 -0.771 . . . . 0.0 109.431 -179.761 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.85 HG13 HG22 ' A' ' 32' ' ' VAL . 4.5 mp -121.23 108.61 22.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.589 0 CA-C-O 122.131 0.967 . . . . 0.0 108.952 179.701 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 1.024 ' HG2' ' HA ' ' A' ' 44' ' ' LYS . 27.2 mtt180 -86.5 -167.02 1.72 Allowed 'General case' 0 C--N 1.319 -0.756 0 CA-C-N 113.116 -1.857 . . . . 0.0 111.507 -179.762 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.547 ' CE2' ' HB2' ' A' ' 46' ' ' ALA . 42.4 m-85 -128.91 151.16 49.95 Favored 'General case' 0 C--O 1.241 0.648 0 N-CA-C 110.4 -0.222 . . . . 0.0 110.4 179.447 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.633 ' HA ' ' CB ' ' A' ' 42' ' ' ASN . 3.8 p90 -147.52 155.52 41.95 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 123.294 0.371 . . . . 0.0 110.669 178.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.626 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 14.9 t80 -83.7 116.89 22.88 Favored 'General case' 0 N--CA 1.473 0.7 0 N-CA-C 112.921 0.712 . . . . 0.0 112.921 -178.62 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.538 ' C ' ' H ' ' A' ' 24' ' ' LYS . 3.2 m120 -110.56 91.11 3.53 Favored 'General case' 0 C--O 1.246 0.902 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.253 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -66.02 15.86 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.776 0 CA-C-O 120.944 0.402 . . . . 0.0 111.693 -179.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . 0.538 ' H ' ' C ' ' A' ' 22' ' ' ASN . 46.5 tptt -97.78 -37.97 9.65 Favored 'General case' 0 C--N 1.345 0.372 0 N-CA-C 108.436 -0.95 . . . . 0.0 108.436 177.455 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -99.18 -15.27 18.99 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 114.836 -1.074 . . . . 0.0 111.073 179.092 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.02 13.28 72.11 Favored Glycine 0 C--N 1.349 1.265 0 N-CA-C 114.663 0.625 . . . . 0.0 114.663 178.413 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 2.2 pt? -154.3 -176.01 5.67 Favored 'General case' 0 N--CA 1.472 0.635 0 CA-C-N 117.307 0.554 . . . . 0.0 111.378 -179.521 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.508 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 31.5 m -84.6 156.38 21.61 Favored 'General case' 0 C--O 1.237 0.396 0 CA-C-N 115.916 -0.584 . . . . 0.0 109.989 178.184 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.626 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 56.1 tp60 -134.78 153.78 51.88 Favored 'General case' 0 C--O 1.238 0.447 0 CA-C-O 120.961 0.41 . . . . 0.0 110.395 -179.725 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.419 ' HB ' ' CG2' ' A' ' 17' ' ' ILE . 35.2 p -78.26 122.97 26.41 Favored 'General case' 0 N--CA 1.47 0.535 0 CA-C-N 114.65 -1.159 . . . . 0.0 111.43 -179.27 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.72 ' O ' ' N ' ' A' ' 18' ' ' ARG . 3.0 p90 -141.91 142.07 33.02 Favored 'General case' 0 CA--C 1.539 0.526 0 CA-C-N 115.258 -0.883 . . . . 0.0 110.49 -179.456 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.85 HG22 HG13 ' A' ' 17' ' ' ILE . 48.3 t -78.01 126.76 38.52 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.569 0 C-N-CA 123.984 0.914 . . . . 0.0 111.462 -179.432 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.491 ' O ' ' HB1' ' A' ' 14' ' ' ALA . 42.1 t80 -112.23 131.8 55.29 Favored 'General case' 0 N--CA 1.465 0.303 0 CA-C-N 115.494 -0.776 . . . . 0.0 110.168 179.629 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.474 ' HA2' ' HB2' ' A' ' 14' ' ' ALA . . . -89.64 153.59 23.36 Favored Glycine 0 C--N 1.34 0.801 0 O-C-N 123.701 0.625 . . . . 0.0 113.238 -179.997 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -95.31 8.89 69.62 Favored Glycine 0 C--N 1.338 0.656 0 O-C-N 123.82 0.364 . . . . 0.0 113.162 179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.2 p -94.94 -43.83 7.99 Favored 'General case' 0 C--O 1.234 0.281 0 C-N-CA 122.503 0.321 . . . . 0.0 110.876 179.661 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.3 mtt-85 -119.27 124.47 46.78 Favored 'General case' 0 C--O 1.236 0.359 0 CA-C-N 115.886 -0.597 . . . . 0.0 109.942 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -111.59 138.07 48.62 Favored 'General case' 0 C--O 1.235 0.314 0 CA-C-N 116.051 -0.522 . . . . 0.0 111.899 -179.169 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.636 ' HZ2' ' HB3' ' A' ' 39' ' ' LYS . 0.5 OUTLIER -142.98 -170.72 3.31 Favored 'General case' 0 C--O 1.236 0.349 0 CA-C-N 115.38 -0.827 . . . . 0.0 109.859 179.575 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . 0.674 ' O ' ' HB2' ' A' ' 2' ' ' PHE . 80.4 mmt-85 -121.62 91.31 3.49 Favored 'General case' 0 C--N 1.329 -0.3 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 177.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.56 ' O ' ' HD1' ' A' ' 2' ' ' PHE . 46.3 t30 -107.57 -52.59 2.74 Favored 'General case' 0 CA--C 1.519 -0.216 0 CA-C-N 116.282 -0.417 . . . . 0.0 110.972 -178.978 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.633 ' CB ' ' HA ' ' A' ' 20' ' ' PHE . 1.1 m120 -160.82 -103.01 0.02 OUTLIER 'General case' 0 N--CA 1.448 -0.541 0 O-C-N 123.447 0.467 . . . . 0.0 110.431 179.026 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.403 ' HB2' ' HB2' ' A' ' 49' ' ' CYS . 55.0 m-85 -150.96 -173.8 4.6 Favored 'General case' 0 C--N 1.35 0.622 0 N-CA-C 113.778 1.029 . . . . 0.0 113.778 -177.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 1.024 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 12.5 tppt? -97.79 -42.24 7.68 Favored 'General case' 0 CA--C 1.539 0.525 0 CA-C-N 114.466 -1.243 . . . . 0.0 109.688 177.741 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.5 m -108.86 155.32 20.95 Favored 'General case' 0 C--O 1.241 0.65 0 CA-C-N 115.758 -0.655 . . . . 0.0 111.906 -179.13 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.547 ' HB2' ' CE2' ' A' ' 19' ' ' TYR . . . -68.41 -37.35 80.26 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-N 115.211 -0.904 . . . . 0.0 112.92 -179.76 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.9 mt-10 -54.35 -50.94 66.27 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 122.701 0.4 . . . . 0.0 111.643 -179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 49.0 m-20 -70.52 -52.33 22.56 Favored 'General case' 0 C--N 1.345 0.39 0 CA-C-N 116.136 -0.484 . . . . 0.0 109.969 178.407 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.432 ' SG ' ' ND2' ' A' ' 42' ' ' ASN . 41.9 t -49.5 -34.59 17.48 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.187 0.595 . . . . 0.0 112.309 179.47 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.613 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 59.0 mtt -78.77 -47.16 17.32 Favored 'General case' 0 C--O 1.242 0.663 0 C-N-CA 122.941 0.496 . . . . 0.0 111.607 179.853 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 65.8 ttt180 -58.05 -33.32 68.9 Favored 'General case' 0 N--CA 1.474 0.771 0 O-C-N 123.799 0.687 . . . . 0.0 111.58 179.65 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 30.9 m -86.22 -55.16 4.05 Favored 'General case' 0 CA--C 1.538 0.484 0 N-CA-C 109.717 -0.475 . . . . 0.0 109.717 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.626 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 2.2 p -149.61 74.25 1.22 Allowed 'General case' 0 CA--C 1.539 0.519 0 CA-C-O 121.059 0.457 . . . . 0.0 112.118 179.998 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.613 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . -178.59 50.74 0.09 OUTLIER Glycine 0 C--N 1.339 0.715 0 C-N-CA 121.199 -0.525 . . . . 0.0 112.728 179.179 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 160.0 46.75 0.02 OUTLIER Glycine 0 C--N 1.339 0.701 0 C-N-CA 121.444 -0.408 . . . . 0.0 112.777 179.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.034 0 CA-C-O 118.244 -0.884 . . . . 0.0 111.148 179.978 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 . . . . . 0 N--CA 1.489 1.498 0 CA-C-O 120.505 0.193 . . . . 0.0 111.087 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.469 ' HE1' ' CZ ' ' A' ' 43' ' ' PHE . 1.3 p90 -125.93 -26.06 3.51 Favored 'General case' 0 N--CA 1.468 0.428 0 CA-C-N 115.924 -0.58 . . . . 0.0 112.044 179.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.555 ' O ' ' HB3' ' A' ' 21' ' ' TYR . 24.9 t -86.67 -14.15 43.42 Favored 'General case' 0 N--CA 1.47 0.545 0 O-C-N 123.222 0.326 . . . . 0.0 111.807 -179.643 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.425 HD22 ' CD2' ' A' ' 21' ' ' TYR . 0.3 OUTLIER -79.67 -8.69 59.37 Favored 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 112.14 0.422 . . . . 0.0 112.14 179.966 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -95.6 157.54 35.94 Favored Pre-proline 0 CA--C 1.539 0.55 0 CA-C-N 116.259 -0.428 . . . . 0.0 110.925 179.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 14.0 Cg_exo -70.58 167.73 24.66 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.85 2.366 . . . . 0.0 112.523 179.821 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.498 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 37.9 Cg_endo -58.25 132.92 51.85 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 123.257 2.638 . . . . 0.0 112.968 -179.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.4 t80 -92.72 -0.53 57.26 Favored 'General case' 0 CA--C 1.543 0.68 0 N-CA-C 112.202 0.445 . . . . 0.0 112.202 -178.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 8.7 m -40.87 -22.94 0.02 OUTLIER 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.901 0.88 . . . . 0.0 113.218 -179.745 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 55.65 -150.92 20.75 Favored Glycine 0 C--N 1.35 1.347 0 CA-C-O 119.409 -0.662 . . . . 0.0 113.511 178.444 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 1.9 Cg_endo -81.9 13.17 2.56 Favored 'Trans proline' 0 C--N 1.368 1.565 0 C-N-CA 123.159 2.573 . . . . 0.0 112.484 178.923 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 5.5 m -84.89 154.58 22.15 Favored 'General case' 0 N--CA 1.468 0.444 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.889 -179.591 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 62.9 mttp -133.32 73.42 1.51 Allowed 'General case' 0 C--O 1.239 0.503 0 CA-C-O 121.341 0.591 . . . . 0.0 111.19 -179.345 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.697 ' HB3' ' HA2' ' A' ' 34' ' ' GLY . . . -86.92 172.26 10.18 Favored 'General case' 0 CA--C 1.539 0.529 0 CA-C-N 115.474 -0.785 . . . . 0.0 111.411 179.736 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.856 ' HE ' ' H ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -110.79 45.14 1.18 Allowed 'General case' 0 CA--C 1.544 0.731 0 CA-C-O 121.015 0.436 . . . . 0.0 111.521 -179.414 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.3 mt -131.81 92.08 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 -179.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 1.141 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.1 mp -76.24 144.25 12.07 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.93 0 CA-C-O 121.565 0.697 . . . . 0.0 110.131 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.95 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 68.1 mtt180 -150.56 -178.23 6.43 Favored 'General case' 0 CA--C 1.536 0.425 0 CA-C-N 113.841 -1.527 . . . . 0.0 110.41 -177.677 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.83 ' HB3' ' SG ' ' A' ' 28' ' ' CYS . 1.5 m-85 -123.31 152.98 40.88 Favored 'General case' 0 N--CA 1.47 0.559 0 N-CA-C 112.108 0.411 . . . . 0.0 112.108 -178.464 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.516 ' HB2' HD21 ' A' ' 41' ' ' ASN . 8.1 p90 -144.76 168.7 19.58 Favored 'General case' 0 CA--C 1.549 0.923 0 O-C-N 124.054 0.846 . . . . 0.0 109.582 178.638 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.684 ' CD2' ' HB2' ' A' ' 53' ' ' CYS . 3.8 t80 -106.86 128.87 54.66 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 113.216 0.821 . . . . 0.0 113.216 -178.527 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.418 ' ND2' ' HB2' ' A' ' 29' ' ' GLN . 69.1 m-80 -105.97 109.95 22.07 Favored 'General case' 0 C--O 1.243 0.716 0 N-CA-C 107.707 -1.219 . . . . 0.0 107.707 175.43 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -80.79 21.3 0.68 Allowed 'General case' 0 CA--C 1.541 0.61 0 CA-C-O 121.249 0.547 . . . . 0.0 110.805 179.79 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 12.7 tppt? -96.19 -23.74 16.58 Favored 'General case' 0 C--N 1.345 0.405 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.522 178.908 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -127.52 -31.15 2.52 Favored 'General case' 0 C--O 1.235 0.34 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.198 179.92 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.415 ' HA2' ' HE1' ' A' ' 21' ' ' TYR . . . 95.44 31.29 7.6 Favored Glycine 0 C--N 1.344 0.978 0 O-C-N 123.391 0.432 . . . . 0.0 112.292 -179.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.5 pp -135.72 163.53 29.96 Favored 'General case' 0 C--O 1.24 0.58 0 CA-C-O 121.007 0.432 . . . . 0.0 111.896 -179.346 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.83 ' SG ' ' HB3' ' A' ' 19' ' ' TYR . 48.9 t -98.5 119.01 36.47 Favored 'General case' 0 C--O 1.235 0.311 0 CA-C-N 115.259 -0.882 . . . . 0.0 109.625 179.36 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.444 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 3.5 tm0? -96.16 153.01 18.03 Favored 'General case' 0 N--CA 1.47 0.547 0 CA-C-N 115.961 -0.563 . . . . 0.0 111.563 -178.074 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.463 HG22 ' CZ ' ' A' ' 19' ' ' TYR . 46.2 p -90.38 123.11 33.85 Favored 'General case' 0 N--CA 1.468 0.464 0 CA-C-N 115.468 -0.787 . . . . 0.0 111.019 179.671 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.447 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 2.6 p90 -143.08 138.05 29.63 Favored 'General case' 0 CA--C 1.54 0.589 0 CA-C-N 115.723 -0.672 . . . . 0.0 110.701 -179.364 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 1.141 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.0 t -80.21 88.43 1.49 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.639 0 C-N-CA 124.524 1.13 . . . . 0.0 113.009 -178.257 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.486 ' HB3' ' HD2' ' A' ' 18' ' ' ARG . 25.0 t80 -52.27 125.38 15.74 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 122.962 0.505 . . . . 0.0 110.995 178.445 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.697 ' HA2' ' HB3' ' A' ' 14' ' ' ALA . . . -83.26 150.46 27.34 Favored Glycine 0 C--N 1.34 0.789 0 CA-C-N 115.871 -0.604 . . . . 0.0 113.495 -179.008 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.41 23.61 23.97 Favored Glycine 0 C--N 1.339 0.716 0 O-C-N 123.785 0.344 . . . . 0.0 112.898 179.668 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 27.9 p -95.06 -46.93 6.6 Favored 'General case' 0 CA--C 1.533 0.326 0 C-N-CA 122.526 0.33 . . . . 0.0 110.451 179.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 9.2 mpt_? -126.57 126.58 43.89 Favored 'General case' 0 C--O 1.235 0.316 0 CA-C-N 115.977 -0.556 . . . . 0.0 109.65 178.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -100.93 131.42 46.81 Favored 'General case' 0 C--O 1.234 0.274 0 N-CA-C 112.247 0.462 . . . . 0.0 112.247 -178.979 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 56.9 tptt -145.54 165.14 29.5 Favored 'General case' 0 N--CA 1.467 0.397 0 CA-C-N 115.154 -0.93 . . . . 0.0 110.052 179.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 46.9 mmm-85 -78.3 1.63 21.14 Favored 'General case' 0 N--CA 1.478 0.964 0 CA-C-N 115.086 -0.961 . . . . 0.0 112.823 -178.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.599 HD22 ' C ' ' A' ' 41' ' ' ASN . 0.2 OUTLIER -89.8 72.61 7.6 Favored 'General case' 0 C--O 1.239 0.543 0 CA-C-O 120.924 0.393 . . . . 0.0 110.431 179.339 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.95 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 74.4 m-80 -156.7 133.69 10.37 Favored 'General case' 0 N--CA 1.469 0.488 0 CA-C-N 115.963 -0.562 . . . . 0.0 111.718 179.172 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.523 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 31.9 m-85 -137.78 101.77 4.55 Favored 'General case' 0 CA--C 1.534 0.345 0 CA-C-N 115.745 -0.662 . . . . 0.0 110.991 179.012 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.731 ' HE2' ' HE ' ' A' ' 18' ' ' ARG . 51.6 mmtt -67.13 -22.85 65.77 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 113.376 0.88 . . . . 0.0 113.376 -179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.9 m -113.76 133.31 55.45 Favored 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.763 0.316 . . . . 0.0 111.834 -179.205 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -64.93 -47.59 77.15 Favored 'General case' 0 N--CA 1.47 0.571 0 CA-C-N 115.669 -0.696 . . . . 0.0 110.915 179.108 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 97.8 mt-10 -48.14 -56.77 7.04 Favored 'General case' 0 N--CA 1.477 0.919 0 O-C-N 123.918 0.761 . . . . 0.0 110.661 179.33 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . 0.705 ' HA ' ' HG2' ' A' ' 51' ' ' ARG . 57.1 m-20 -58.99 -49.66 77.04 Favored 'General case' 0 N--CA 1.471 0.614 0 C-N-CA 122.608 0.363 . . . . 0.0 110.588 178.765 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . . . . . . . . . 15.5 t -46.4 -49.74 17.59 Favored 'General case' 0 N--CA 1.477 0.921 0 O-C-N 123.934 0.771 . . . . 0.0 111.135 179.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 96.0 mtp -68.9 -43.55 75.02 Favored 'General case' 0 CA--C 1.539 0.548 0 N-CA-C 112.443 0.534 . . . . 0.0 112.443 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.705 ' HG2' ' HA ' ' A' ' 48' ' ' ASP . 33.3 ptt180 -70.21 -16.19 63.02 Favored 'General case' 0 N--CA 1.477 0.908 0 N-CA-C 112.441 0.534 . . . . 0.0 112.441 -179.631 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 7.8 m -102.94 -49.56 3.75 Favored 'General case' 0 CA--C 1.541 0.604 0 O-C-N 123.209 0.318 . . . . 0.0 110.604 179.756 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.684 ' HB2' ' CD2' ' A' ' 21' ' ' TYR . 1.3 p -123.48 34.81 5.0 Favored 'General case' 0 CA--C 1.546 0.819 0 N-CA-C 113.094 0.776 . . . . 0.0 113.094 -179.22 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -128.38 -99.37 0.97 Allowed Glycine 0 N--CA 1.459 0.197 0 C-N-CA 121.083 -0.58 . . . . 0.0 112.458 179.884 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 171.58 61.11 0.04 OUTLIER Glycine 0 C--N 1.337 0.614 0 C-N-CA 121.397 -0.43 . . . . 0.0 112.45 179.99 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.071 0 CA-C-O 118.226 -0.892 . . . . 0.0 111.088 -179.999 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . 0.529 ' OD2' HD21 ' A' ' 4' ' ' LEU . 47.8 t0 . . . . . 0 N--CA 1.486 1.372 0 CA-C-O 120.553 0.216 . . . . 0.0 110.616 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 6.4 p90 -128.5 -173.21 2.9 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.104 179.954 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.543 ' HA ' ' ND2' ' A' ' 41' ' ' ASN . 26.4 t 70.64 -47.9 0.65 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.705 1.202 . . . . 0.0 112.796 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.547 ' HA ' ' O ' ' A' ' 21' ' ' TYR . 3.7 pp -81.85 -6.38 59.03 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 112.073 0.397 . . . . 0.0 112.073 179.66 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . 0.442 ' HB3' ' HD2' ' A' ' 6' ' ' PRO . 55.2 mm-40 -87.32 163.85 37.89 Favored Pre-proline 0 CA--C 1.543 0.691 0 CA-C-N 116.038 -0.528 . . . . 0.0 110.562 179.497 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.442 ' HD2' ' HB3' ' A' ' 5' ' ' GLU . 13.7 Cg_endo -56.36 130.12 38.42 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.555 2.17 . . . . 0.0 113.223 -179.655 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.566 ' HD3' ' CE2' ' A' ' 20' ' ' PHE . 21.4 Cg_endo -52.71 136.04 57.7 Favored 'Trans proline' 0 C--N 1.372 1.792 0 C-N-CA 124.121 3.214 . . . . 0.0 114.408 -179.435 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 80.6 t80 -130.1 117.49 20.05 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.558 -0.746 . . . . 0.0 110.612 -179.771 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.422 HG23 ' HA ' ' A' ' 33' ' ' TYR . 41.2 m -96.28 -71.94 0.65 Allowed 'General case' 0 CA--C 1.539 0.557 0 CA-C-N 116.143 -0.48 . . . . 0.0 110.378 179.389 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.466 ' HA3' ' CB ' ' A' ' 37' ' ' ARG . . . 112.03 147.66 10.58 Favored Glycine 0 C--N 1.34 0.775 0 CA-C-O 119.146 -0.808 . . . . 0.0 111.511 -178.772 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.408 ' HD3' ' HA2' ' A' ' 10' ' ' GLY . 2.7 Cg_exo -76.4 49.12 2.54 Favored 'Trans proline' 0 C--N 1.368 1.553 0 C-N-CA 122.882 2.388 . . . . 0.0 113.055 -179.363 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . 0.69 ' HB2' ' HG2' ' A' ' 37' ' ' ARG . 0.0 OUTLIER -146.53 133.04 19.73 Favored 'General case' 0 N--CA 1.47 0.534 0 CA-C-N 116.021 -0.536 . . . . 0.0 112.309 179.705 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.788 ' HE2' ' H ' ' A' ' 13' ' ' LYS . 0.4 OUTLIER 28.99 47.28 0.02 OUTLIER 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 125.196 1.398 . . . . 0.0 114.549 178.796 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.652 ' HA ' ' HA2' ' A' ' 34' ' ' GLY . . . -89.52 100.25 13.09 Favored 'General case' 0 C--O 1.237 0.419 0 CA-C-N 115.847 -0.615 . . . . 0.0 111.913 -179.511 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 2.8 ptm180 -155.54 30.56 0.38 Allowed 'General case' 0 N--CA 1.478 0.948 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.386 179.918 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.489 ' O ' ' N ' ' A' ' 33' ' ' TYR . 46.8 mt -143.07 128.92 16.66 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.668 0 CA-C-N 115.602 -0.726 . . . . 0.0 109.692 -179.943 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.798 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 4.2 mp -93.66 142.8 12.75 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.799 0 N-CA-C 109.037 -0.727 . . . . 0.0 109.037 178.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.67 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 37.8 mtt180 -137.19 -176.24 4.32 Favored 'General case' 0 C--N 1.324 -0.517 0 CA-C-N 114.1 -1.409 . . . . 0.0 110.678 -177.723 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.533 ' HA ' ' O ' ' A' ' 29' ' ' GLN . 2.1 m-85 -116.64 148.03 41.36 Favored 'General case' 0 N--CA 1.467 0.388 0 CA-C-O 120.686 0.279 . . . . 0.0 111.584 -179.708 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.864 ' HB2' HD21 ' A' ' 41' ' ' ASN . 2.9 p90 -139.54 155.63 47.39 Favored 'General case' 0 C--O 1.237 0.424 0 N-CA-C 108.692 -0.855 . . . . 0.0 108.692 178.617 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.59 ' CZ ' ' HA2' ' A' ' 26' ' ' GLY . 68.4 t80 -90.38 131.97 35.86 Favored 'General case' 0 C--O 1.234 0.285 0 N-CA-C 112.061 0.393 . . . . 0.0 112.061 -179.648 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 4.7 m120 -99.87 130.46 46.06 Favored 'General case' 0 C--O 1.24 0.57 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 176.962 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -90.39 9.93 27.06 Favored 'General case' 0 C--O 1.237 0.442 0 O-C-N 123.349 0.406 . . . . 0.0 111.781 -179.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -97.61 -24.74 15.39 Favored 'General case' 0 N--CA 1.464 0.274 0 CA-C-N 116.491 -0.322 . . . . 0.0 111.048 179.301 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -134.97 -28.93 1.15 Allowed 'General case' 0 C--O 1.235 0.321 0 CA-C-N 115.659 -0.7 . . . . 0.0 112.672 -178.668 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.59 ' HA2' ' CZ ' ' A' ' 21' ' ' TYR . . . 95.95 8.62 57.89 Favored Glycine 0 C--N 1.342 0.914 0 C-N-CA 120.984 -0.627 . . . . 0.0 112.297 -178.763 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . . . . . . . . . 3.4 pp -95.7 151.61 19.21 Favored 'General case' 0 C--O 1.237 0.438 0 O-C-N 123.834 0.373 . . . . 0.0 111.901 -179.435 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.501 ' HA ' ' O ' ' A' ' 20' ' ' PHE . 96.4 m -96.13 109.97 22.32 Favored 'General case' 0 C--O 1.237 0.423 0 CA-C-N 115.357 -0.838 . . . . 0.0 109.124 178.73 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.585 ' HB3' ' CE1' ' A' ' 20' ' ' PHE . 53.4 tp60 -92.15 156.94 17.0 Favored 'General case' 0 CA--C 1.534 0.358 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.031 -177.542 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.468 HG22 ' CE1' ' A' ' 19' ' ' TYR . 34.0 p -89.78 128.37 36.13 Favored 'General case' 0 N--CA 1.469 0.5 0 CA-C-N 114.818 -1.083 . . . . 0.0 111.294 -179.942 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.578 ' CE1' ' HB3' ' A' ' 20' ' ' PHE . 6.9 p90 -150.66 150.52 31.23 Favored 'General case' 0 CA--C 1.54 0.582 0 CA-C-N 115.588 -0.733 . . . . 0.0 109.796 179.994 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.798 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 4.2 t -76.74 161.35 4.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.82 0 C-N-CA 123.656 0.783 . . . . 0.0 112.395 -177.972 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.489 ' N ' ' O ' ' A' ' 16' ' ' ILE . 32.7 t80 -136.85 158.17 45.08 Favored 'General case' 0 C--O 1.236 0.384 0 CA-C-N 114.241 -1.345 . . . . 0.0 109.904 179.948 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.652 ' HA2' ' HA ' ' A' ' 14' ' ' ALA . . . -105.76 -164.33 23.31 Favored Glycine 0 C--N 1.336 0.531 0 C-N-CA 121.146 -0.549 . . . . 0.0 113.324 -179.745 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . 0.518 ' HA3' ' HB2' ' A' ' 13' ' ' LYS . . . -109.47 -60.83 0.52 Allowed Glycine 0 C--N 1.339 0.699 0 O-C-N 123.788 0.346 . . . . 0.0 112.716 -179.74 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . 0.569 ' SG ' ' HD2' ' A' ' 13' ' ' LYS . 0.0 OUTLIER -80.05 -19.56 47.31 Favored 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 112.528 0.566 . . . . 0.0 112.528 179.757 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.69 ' HG2' ' HB2' ' A' ' 12' ' ' CYS . 71.9 mmt-85 -96.85 102.95 14.82 Favored 'General case' 0 C--O 1.238 0.453 0 CA-C-O 121.053 0.454 . . . . 0.0 110.851 179.893 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -120.42 148.49 43.72 Favored 'General case' 0 C--O 1.234 0.272 0 CA-C-N 115.494 -0.775 . . . . 0.0 111.569 -179.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . . . . . . . . . 2.9 tmtp? -137.13 -124.78 0.14 Allowed 'General case' 0 CA--C 1.548 0.883 0 CA-C-N 115.63 -0.714 . . . . 0.0 109.482 179.912 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 23.9 mmm180 -143.99 -1.24 0.98 Allowed 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 122.781 0.433 . . . . 0.0 111.622 179.577 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.864 HD21 ' HB2' ' A' ' 20' ' ' PHE . 0.2 OUTLIER -109.15 78.48 1.14 Allowed 'General case' 0 C--O 1.239 0.504 0 CA-C-O 120.807 0.337 . . . . 0.0 111.737 -179.058 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.67 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 9.3 m120 -155.63 123.89 5.85 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.81 177.472 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.526 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 36.5 m-85 -134.65 103.32 5.61 Favored 'General case' 0 CA--C 1.532 0.277 0 CA-C-N 114.99 -1.004 . . . . 0.0 110.138 179.451 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.434 ' HG2' ' HG2' ' A' ' 18' ' ' ARG . 6.5 tmtt? -74.31 0.62 13.73 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 112.387 0.514 . . . . 0.0 112.387 -179.002 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.2 m -134.92 134.22 40.4 Favored 'General case' 0 C--O 1.239 0.512 0 CA-C-N 116.641 -0.254 . . . . 0.0 111.269 179.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -63.93 -45.99 86.75 Favored 'General case' 0 N--CA 1.471 0.602 0 CA-C-N 115.898 -0.592 . . . . 0.0 111.295 179.403 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 66.6 tt0 -49.11 -55.96 10.6 Favored 'General case' 0 N--CA 1.477 0.897 0 O-C-N 123.781 0.676 . . . . 0.0 110.786 -179.991 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 53.0 m-20 -62.53 -47.45 83.84 Favored 'General case' 0 N--CA 1.472 0.625 0 C-N-CA 122.398 0.279 . . . . 0.0 110.763 178.768 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.506 ' O ' ' SG ' ' A' ' 53' ' ' CYS . 53.7 t -46.68 -48.96 20.0 Favored 'General case' 0 N--CA 1.479 0.995 0 O-C-N 123.824 0.702 . . . . 0.0 111.37 179.838 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 65.5 mtt -73.69 -39.26 64.51 Favored 'General case' 0 CA--C 1.538 0.5 0 N-CA-C 112.175 0.435 . . . . 0.0 112.175 179.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 86.8 mtm180 -69.13 -19.76 64.03 Favored 'General case' 0 N--CA 1.477 0.893 0 N-CA-C 113.268 0.84 . . . . 0.0 113.268 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . . . . . . . . . 8.5 m -105.72 -51.49 2.99 Favored 'General case' 0 CA--C 1.538 0.504 0 O-C-N 122.983 0.177 . . . . 0.0 110.841 -179.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.506 ' SG ' ' O ' ' A' ' 49' ' ' CYS . 0.2 OUTLIER -109.42 21.04 17.55 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 113.261 0.837 . . . . 0.0 113.261 -178.681 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -107.23 -62.56 0.58 Allowed Glycine 0 C--N 1.34 0.755 0 C-N-CA 120.608 -0.806 . . . . 0.0 112.545 178.589 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 166.85 79.09 0.04 OUTLIER Glycine 0 C--N 1.337 0.611 0 C-N-CA 121.467 -0.396 . . . . 0.0 112.493 179.949 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.031 0 CA-C-O 118.251 -0.88 . . . . 0.0 111.087 179.975 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.9 m-20 . . . . . 0 N--CA 1.488 1.468 0 CA-C-O 120.519 0.2 . . . . 0.0 111.115 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . . . . . . . . . 0.9 OUTLIER -127.82 -164.87 1.41 Allowed 'General case' 0 CA--C 1.542 0.638 0 CA-C-N 115.865 -0.607 . . . . 0.0 111.238 -179.974 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . 0.722 ' SG ' ' HB2' ' A' ' 21' ' ' TYR . 13.9 t 72.51 -39.66 0.45 Allowed 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 124.808 1.243 . . . . 0.0 112.35 179.902 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.435 HD23 ' CD1' ' A' ' 21' ' ' TYR . 23.1 mt -79.51 -4.95 53.67 Favored 'General case' 0 N--CA 1.473 0.718 0 N-CA-C 112.139 0.422 . . . . 0.0 112.139 179.554 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 98.0 mt-10 -95.14 151.37 38.74 Favored Pre-proline 0 CA--C 1.538 0.49 0 CA-C-N 116.482 -0.326 . . . . 0.0 111.198 -179.998 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . 0.408 ' HA ' ' HE2' ' A' ' 20' ' ' PHE . 39.2 Cg_endo -67.18 169.34 15.43 Favored 'Trans proline' 0 C--N 1.372 1.788 0 C-N-CA 122.927 2.418 . . . . 0.0 112.908 -179.998 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . 0.585 ' HD3' ' CZ ' ' A' ' 20' ' ' PHE . 36.5 Cg_endo -57.81 130.01 36.35 Favored 'Trans proline' 0 C--N 1.376 2.007 0 C-N-CA 123.037 2.491 . . . . 0.0 113.101 179.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.959 ' HB3' ' HD3' ' A' ' 39' ' ' LYS . 9.9 t80 -95.22 -19.76 19.77 Favored 'General case' 0 CA--C 1.535 0.397 0 N-CA-C 112.764 0.653 . . . . 0.0 112.764 -178.773 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.592 ' C ' ' O ' ' A' ' 8' ' ' TYR . 2.6 m -8.94 -80.67 0.0 OUTLIER 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.613 0.765 . . . . 0.0 109.609 -176.876 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . . . . . . . . . . . 124.39 -159.47 19.01 Favored Glycine 0 CA--C 1.527 0.819 0 C-N-CA 120.897 -0.668 . . . . 0.0 112.611 178.964 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . . . . . . . . . 5.9 Cg_exo -78.72 13.07 2.0 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 123.073 2.515 . . . . 0.0 113.143 -179.977 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 38.6 m -94.85 -59.53 1.89 Allowed 'General case' 0 N--CA 1.464 0.24 0 CA-C-N 116.159 -0.473 . . . . 0.0 110.928 -179.925 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 72.7 mmtt 57.51 91.23 0.04 OUTLIER 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.095 0.958 . . . . 0.0 112.33 179.83 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . 0.504 ' CB ' ' HA2' ' A' ' 34' ' ' GLY . . . -80.98 -158.33 0.2 Allowed 'General case' 0 CA--C 1.542 0.672 0 CA-C-N 115.2 -0.909 . . . . 0.0 111.402 -179.889 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -126.68 37.71 4.25 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-O 121.071 0.462 . . . . 0.0 111.814 -179.513 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . . . . . . . . . 25.0 mt -129.96 91.74 1.62 Allowed 'Isoleucine or valine' 0 CA--C 1.543 0.678 0 CA-C-N 115.979 -0.555 . . . . 0.0 110.712 -179.641 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.894 HG13 HG22 ' A' ' 32' ' ' VAL . 2.9 mp -76.39 153.87 5.85 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.941 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.079 179.941 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.628 HH11 ' ND2' ' A' ' 42' ' ' ASN . 39.2 mtt180 -154.8 -179.59 8.17 Favored 'General case' 0 CA--C 1.538 0.496 0 CA-C-N 114.429 -1.26 . . . . 0.0 109.625 -177.952 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.749 ' HB2' ' O ' ' A' ' 43' ' ' PHE . 2.2 m-85 -112.39 156.91 21.72 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-N 118.32 0.509 . . . . 0.0 111.731 -179.983 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.585 ' CZ ' ' HD3' ' A' ' 7' ' ' PRO . 1.8 p90 -158.56 167.05 30.63 Favored 'General case' 0 N--CA 1.478 0.941 0 O-C-N 124.597 1.186 . . . . 0.0 108.981 179.518 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.722 ' HB2' ' SG ' ' A' ' 3' ' ' CYS . 5.5 t80 -81.71 133.8 35.39 Favored 'General case' 0 N--CA 1.481 1.076 0 CA-C-N 118.419 0.554 . . . . 0.0 112.166 -179.149 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . 0.568 ' ND2' ' HB3' ' A' ' 29' ' ' GLN . 67.8 m-80 -141.27 112.88 7.61 Favored 'General case' 0 C--O 1.244 0.766 0 CA-C-N 115.407 -0.815 . . . . 0.0 111.104 178.471 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . . . . . . . . . . . -76.92 7.28 4.99 Favored 'General case' 0 CA--C 1.546 0.794 0 CA-C-N 115.646 -0.706 . . . . 0.0 110.0 177.969 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 18.4 ttmm -96.87 -41.04 8.63 Favored 'General case' 0 C--N 1.348 0.537 0 CA-C-N 114.907 -1.042 . . . . 0.0 110.017 179.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -85.44 -48.05 9.37 Favored 'General case' 0 C--O 1.234 0.274 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.981 179.632 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 169.49 -62.54 0.18 Allowed Glycine 0 C--N 1.336 0.576 0 CA-C-N 115.405 -0.816 . . . . 0.0 111.659 -179.839 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.726 HD12 ' N ' ' A' ' 28' ' ' CYS . 2.3 pp -150.62 -52.49 0.14 Allowed 'General case' 0 N--CA 1.468 0.426 0 C-N-CA 122.368 0.267 . . . . 0.0 110.822 179.676 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . 0.726 ' N ' HD12 ' A' ' 27' ' ' LEU . 58.5 m -133.86 144.64 49.05 Favored 'General case' 0 N--CA 1.466 0.336 0 C-N-CA 122.538 0.335 . . . . 0.0 110.24 -179.971 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.568 ' HB3' ' ND2' ' A' ' 22' ' ' ASN . 63.3 tp60 -145.81 159.23 43.5 Favored 'General case' 0 N--CA 1.47 0.559 0 CA-C-O 121.405 0.622 . . . . 0.0 112.273 -178.76 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.525 ' HA ' ' O ' ' A' ' 18' ' ' ARG . 34.9 p -77.54 142.28 39.12 Favored 'General case' 0 N--CA 1.472 0.662 0 CA-C-N 113.946 -1.479 . . . . 0.0 112.244 -178.696 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.599 ' O ' ' N ' ' A' ' 18' ' ' ARG . 6.7 p90 -152.64 147.35 26.04 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-N 115.247 -0.888 . . . . 0.0 109.388 179.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.894 HG22 HG13 ' A' ' 17' ' ' ILE . 3.2 t -99.13 110.37 26.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.491 0 C-N-CA 123.241 0.617 . . . . 0.0 111.363 -179.924 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.426 ' O ' ' HB3' ' A' ' 14' ' ' ALA . 48.8 t80 -78.49 136.07 37.5 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 110.113 -0.329 . . . . 0.0 110.113 178.702 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . 0.504 ' HA2' ' CB ' ' A' ' 14' ' ' ALA . . . -92.59 155.59 22.75 Favored Glycine 0 C--N 1.338 0.664 0 O-C-N 123.561 0.538 . . . . 0.0 112.906 -179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -98.66 11.95 62.87 Favored Glycine 0 C--N 1.337 0.625 0 C-N-CA 121.433 -0.413 . . . . 0.0 113.346 -179.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 17.5 p -95.14 -44.61 7.56 Favored 'General case' 0 N--CA 1.467 0.394 0 CA-C-N 116.771 0.285 . . . . 0.0 110.73 179.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . . . . . . . . . 88.4 mtt-85 -124.76 153.49 42.36 Favored 'General case' 0 N--CA 1.465 0.307 0 CA-C-N 115.725 -0.67 . . . . 0.0 110.025 179.542 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -100.6 151.02 22.1 Favored 'General case' 0 C--O 1.236 0.344 0 CA-C-O 121.276 0.56 . . . . 0.0 112.161 -179.392 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.959 ' HD3' ' HB3' ' A' ' 8' ' ' TYR . 13.0 ttpp -134.07 165.18 25.66 Favored 'General case' 0 CA--C 1.538 0.502 0 CA-C-N 114.605 -1.18 . . . . 0.0 110.356 -179.194 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 86.4 mtm180 -112.47 18.7 18.23 Favored 'General case' 0 N--CA 1.472 0.666 0 CA-C-N 115.309 -0.859 . . . . 0.0 111.648 -179.771 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.919 ' H ' ' HG2' ' A' ' 39' ' ' LYS . 0.3 OUTLIER -126.96 97.45 4.97 Favored 'General case' 0 CA--C 1.533 0.322 0 CA-C-O 121.172 0.51 . . . . 0.0 110.936 179.751 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.628 ' ND2' HH11 ' A' ' 18' ' ' ARG . 8.3 m120 -146.23 147.93 31.95 Favored 'General case' 0 C--O 1.234 0.283 0 CA-C-N 115.457 -0.792 . . . . 0.0 110.543 178.711 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.749 ' O ' ' HB2' ' A' ' 19' ' ' TYR . 56.1 m-85 -160.53 81.19 0.67 Allowed 'General case' 0 N--CA 1.469 0.516 0 O-C-N 123.759 0.662 . . . . 0.0 109.853 176.921 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . 0.519 ' HA ' ' HG2' ' A' ' 18' ' ' ARG . 20.2 tptm -43.25 -28.04 0.28 Allowed 'General case' 0 N--CA 1.484 1.275 0 N-CA-C 114.187 1.18 . . . . 0.0 114.187 -178.158 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 52.4 m -136.65 154.91 50.51 Favored 'General case' 0 C--O 1.239 0.521 0 CA-C-O 120.666 0.269 . . . . 0.0 111.636 -179.866 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.419 ' O ' ' HB3' ' A' ' 49' ' ' CYS . . . -59.62 -50.62 73.17 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 115.895 -0.593 . . . . 0.0 110.51 179.028 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.489 ' O ' ' HB2' ' A' ' 51' ' ' ARG . 71.8 tt0 -43.63 -51.13 7.18 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 123.931 0.77 . . . . 0.0 110.474 179.578 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 7.6 t0 -66.07 -39.14 89.82 Favored 'General case' 0 C--O 1.242 0.681 0 CA-C-N 116.25 -0.432 . . . . 0.0 110.42 178.507 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.456 ' HA ' ' CD1' ' A' ' 43' ' ' PHE . 41.9 t -55.5 -59.24 5.11 Favored 'General case' 0 C--N 1.355 0.843 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 178.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . 0.524 ' HA ' ' HA3' ' A' ' 54' ' ' GLY . 66.9 mtt -60.97 -31.96 71.52 Favored 'General case' 0 CA--C 1.538 0.488 0 C-N-CA 122.884 0.474 . . . . 0.0 111.011 177.913 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . 0.489 ' HB2' ' O ' ' A' ' 47' ' ' GLU . 5.4 tmm_? -58.11 -41.94 84.65 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 115.544 -0.753 . . . . 0.0 111.57 -179.914 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.433 ' HB ' ' CZ ' ' A' ' 43' ' ' PHE . 7.6 m -101.24 -51.31 3.54 Favored 'General case' 0 CA--C 1.546 0.794 0 N-CA-C 111.887 0.329 . . . . 0.0 111.887 -179.426 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . . . . . . . . . 0.5 OUTLIER -102.13 12.04 37.4 Favored 'General case' 0 N--CA 1.473 0.676 0 N-CA-C 113.831 1.048 . . . . 0.0 113.831 -178.529 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . 0.524 ' HA3' ' HA ' ' A' ' 50' ' ' MET . . . -98.87 -61.06 0.87 Allowed Glycine 0 C--N 1.341 0.841 0 C-N-CA 120.586 -0.816 . . . . 0.0 112.581 179.279 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . -111.75 -103.09 2.67 Favored Glycine 0 C--N 1.337 0.589 0 C-N-CA 121.4 -0.429 . . . . 0.0 112.549 179.914 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 0.988 0 CA-C-O 118.334 -0.841 . . . . 0.0 111.014 -179.961 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' ASP . . . . . . . . . . . . . 53.7 m-20 . . . . . 0 N--CA 1.487 1.422 0 CA-C-O 120.532 0.206 . . . . 0.0 111.152 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' PHE . . . . . 0.507 ' HB2' ' HB2' ' A' ' 41' ' ' ASN . 2.5 p90 -104.57 -29.76 10.44 Favored 'General case' 0 N--CA 1.467 0.404 0 CA-C-N 115.913 -0.585 . . . . 0.0 111.926 -179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' CYS . . . . . . . . . . . . . 1.2 m -83.57 -35.69 24.54 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 111.868 0.322 . . . . 0.0 111.868 179.755 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LEU . . . . . 0.559 ' HA ' ' HB2' ' A' ' 23' ' ' ALA . 4.3 mm? -80.54 -8.18 59.49 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 116.493 -0.321 . . . . 0.0 111.547 179.083 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -112.26 155.39 43.65 Favored Pre-proline 0 CA--C 1.537 0.471 0 CA-C-N 115.942 -0.572 . . . . 0.0 110.395 179.307 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -61.52 142.83 96.3 Favored 'Trans proline' 0 C--N 1.371 1.748 0 C-N-CA 122.706 2.27 . . . . 0.0 113.392 -179.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' PRO . . . . . . . . . . . . . 51.3 Cg_endo -61.56 165.35 13.61 Favored 'Trans proline' 0 C--N 1.372 1.796 0 C-N-CA 123.522 2.815 . . . . 0.0 113.395 -179.756 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . 0.744 ' HD2' ' HB2' ' A' ' 39' ' ' LYS . 15.1 t80 -125.57 35.18 4.77 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 116.178 -0.465 . . . . 0.0 111.623 -179.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.528 HG23 ' O ' ' A' ' 32' ' ' VAL . 7.0 m -57.92 -41.69 83.22 Favored 'General case' 0 N--CA 1.476 0.851 0 CA-C-N 116.429 -0.351 . . . . 0.0 111.093 179.576 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' GLY . . . . . 0.637 ' HA3' ' NE ' ' A' ' 37' ' ' ARG . . . 70.91 -165.17 53.14 Favored Glycine 0 CA--C 1.532 1.129 0 CA-C-O 119.318 -0.712 . . . . 0.0 113.027 179.666 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PRO . . . . . 0.466 ' HD3' HH21 ' A' ' 37' ' ' ARG . 3.0 Cg_exo -80.83 16.75 1.54 Allowed 'Trans proline' 0 C--N 1.368 1.566 0 C-N-CA 123.052 2.501 . . . . 0.0 112.824 179.433 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -119.77 114.86 22.78 Favored 'General case' 0 C--O 1.235 0.321 0 CA-C-N 116.035 -0.53 . . . . 0.0 111.624 -179.786 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 3.0 mppt? -142.04 83.23 1.83 Allowed 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.024 -0.989 . . . . 0.0 109.154 179.857 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -78.44 -104.44 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 N-CA-C 112.848 0.684 . . . . 0.0 112.848 -178.107 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ARG . . . . . 0.558 ' HD3' ' N ' ' A' ' 15' ' ' ARG . 0.0 OUTLIER -137.98 34.36 2.37 Favored 'General case' 0 N--CA 1.473 0.679 0 CA-C-O 121.044 0.45 . . . . 0.0 112.197 -178.428 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ILE . . . . . 0.535 ' HB ' ' O ' ' A' ' 33' ' ' TYR . 23.1 mt -127.54 61.92 0.3 Allowed 'Isoleucine or valine' 0 CA--C 1.542 0.668 0 CA-C-O 121.801 0.81 . . . . 0.0 109.62 179.972 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ILE . . . . . 0.947 ' HA ' ' HA ' ' A' ' 32' ' ' VAL . 3.5 mp -69.82 126.7 30.48 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 CA-C-N 114.919 -1.037 . . . . 0.0 110.57 -179.826 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ARG . . . . . 0.968 ' HD3' ' HB3' ' A' ' 42' ' ' ASN . 71.2 mtt180 -127.64 -179.73 5.08 Favored 'General case' 0 C--N 1.318 -0.779 0 CA-C-N 113.032 -1.895 . . . . 0.0 108.805 -179.548 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' TYR . . . . . 0.673 ' O ' ' HB2' ' A' ' 43' ' ' PHE . 2.5 m-85 -111.45 153.92 25.43 Favored 'General case' 0 N--CA 1.483 1.204 0 N-CA-C 114.181 1.178 . . . . 0.0 114.181 -177.835 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . 0.586 ' CE2' ' HB3' ' A' ' 29' ' ' GLN . 0.3 OUTLIER -142.98 145.15 32.69 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 178.465 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' TYR . . . . . 0.482 ' CG ' ' HB2' ' A' ' 53' ' ' CYS . 44.9 t80 -101.39 119.21 38.41 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 112.364 0.505 . . . . 0.0 112.364 -179.293 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -80.21 93.72 5.92 Favored 'General case' 0 C--O 1.241 0.609 0 N-CA-C 108.04 -1.096 . . . . 0.0 108.04 177.768 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ALA . . . . . 0.559 ' HB2' ' HA ' ' A' ' 4' ' ' LEU . . . -56.9 -13.32 2.54 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 114.086 1.143 . . . . 0.0 114.086 -177.673 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' LYS . . . . . . . . . . . . . 55.1 tttm -95.55 -34.65 11.95 Favored 'General case' 0 C--N 1.348 0.54 0 CA-C-N 118.401 0.546 . . . . 0.0 110.942 -179.635 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' ALA . . . . . . . . . . . . . . . -79.62 -31.42 41.66 Favored 'General case' 0 N--CA 1.467 0.385 0 CA-C-N 116.015 -0.539 . . . . 0.0 111.914 -179.938 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.6 -15.23 61.26 Favored Glycine 0 C--N 1.34 0.785 0 O-C-N 123.414 0.446 . . . . 0.0 112.999 -179.996 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LEU . . . . . 0.604 HD13 ' H ' ' A' ' 27' ' ' LEU . 0.0 OUTLIER -115.55 170.64 8.27 Favored 'General case' 0 C--O 1.244 0.764 0 CA-C-O 121.141 0.496 . . . . 0.0 112.122 -179.395 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' CYS . . . . . . . . . . . . . 17.5 t -93.55 157.64 16.09 Favored 'General case' 0 C--O 1.236 0.365 0 CA-C-N 115.412 -0.813 . . . . 0.0 110.154 179.614 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' GLN . . . . . 0.586 ' HB3' ' CE2' ' A' ' 20' ' ' PHE . 25.2 tt0 -144.88 130.95 19.37 Favored 'General case' 0 C--O 1.237 0.425 0 CA-C-N 116.27 -0.423 . . . . 0.0 110.172 -178.983 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 48.3 p -77.33 139.65 39.82 Favored 'General case' 0 N--CA 1.473 0.677 0 N-CA-C 112.882 0.697 . . . . 0.0 112.882 -177.795 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PHE . . . . . 0.616 ' O ' ' N ' ' A' ' 18' ' ' ARG . 18.4 p90 -138.13 159.41 42.1 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 114.843 -1.071 . . . . 0.0 109.625 179.421 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' VAL . . . . . 0.947 ' HA ' ' HA ' ' A' ' 17' ' ' ILE . 3.1 t -97.89 164.52 2.32 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.611 0 C-N-CA 123.643 0.777 . . . . 0.0 110.512 -179.931 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.535 ' O ' ' HB ' ' A' ' 16' ' ' ILE . 45.3 t80 -137.49 157.21 47.04 Favored 'General case' 0 CA--C 1.535 0.398 0 CA-C-N 115.818 -0.628 . . . . 0.0 109.693 179.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . -159.14 -167.11 19.38 Favored Glycine 0 C--N 1.337 0.628 0 C-N-CA 121.101 -0.571 . . . . 0.0 113.027 -179.875 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLY . . . . . . . . . . . . . . . -91.72 12.57 69.06 Favored Glycine 0 C--N 1.34 0.775 0 C-N-CA 121.609 -0.329 . . . . 0.0 113.185 179.926 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' CYS . . . . . . . . . . . . . 0.0 OUTLIER -94.99 -34.75 12.24 Favored 'General case' 0 C--O 1.235 0.33 0 C-N-CA 122.761 0.425 . . . . 0.0 112.007 179.716 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' ARG . . . . . 0.637 ' NE ' ' HA3' ' A' ' 10' ' ' GLY . 87.2 mtt-85 -132.36 150.95 52.05 Favored 'General case' 0 N--CA 1.467 0.392 0 O-C-N 123.22 0.325 . . . . 0.0 110.513 179.282 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -142.98 118.04 10.07 Favored 'General case' 0 C--O 1.237 0.402 0 CA-C-N 116.153 -0.476 . . . . 0.0 111.414 -179.942 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.744 ' HB2' ' HD2' ' A' ' 8' ' ' TYR . 0.2 OUTLIER -148.42 174.93 11.56 Favored 'General case' 0 N--CA 1.467 0.423 0 CA-C-N 115.561 -0.745 . . . . 0.0 110.228 179.795 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 39.5 mmt180 -75.97 -51.28 12.74 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.099 -0.955 . . . . 0.0 112.16 -177.846 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASN . . . . . 0.507 ' HB2' ' HB2' ' A' ' 2' ' ' PHE . 0.4 OUTLIER -53.49 92.28 0.01 OUTLIER 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 113.133 0.79 . . . . 0.0 113.133 -178.405 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ASN . . . . . 0.968 ' HB3' ' HD3' ' A' ' 18' ' ' ARG . 8.5 m120 -157.78 109.22 2.28 Favored 'General case' 0 C--O 1.239 0.552 0 CA-C-N 114.559 -1.201 . . . . 0.0 108.914 177.697 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PHE . . . . . 0.673 ' HB2' ' O ' ' A' ' 19' ' ' TYR . 0.7 OUTLIER -97.42 -168.53 1.7 Allowed 'General case' 0 CA--C 1.535 0.366 0 N-CA-C 115.121 1.526 . . . . 0.0 115.121 -176.655 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' LYS . . . . . . . . . . . . . 0.5 OUTLIER -101.93 -68.58 0.82 Allowed 'General case' 0 N--CA 1.466 0.333 0 CA-C-N 113.242 -1.799 . . . . 0.0 112.609 178.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.45 ' HA ' ' CE2' ' A' ' 19' ' ' TYR . 52.6 m -154.43 177.35 11.26 Favored 'General case' 0 N--CA 1.47 0.538 0 CA-C-N 115.726 -0.67 . . . . 0.0 110.268 -178.94 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -57.32 -37.32 72.32 Favored 'General case' 0 N--CA 1.477 0.894 0 N-CA-C 112.838 0.681 . . . . 0.0 112.838 -179.653 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 5.8 mm-40 -59.48 -54.46 46.35 Favored 'General case' 0 N--CA 1.476 0.862 0 O-C-N 123.356 0.41 . . . . 0.0 111.187 179.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ASP . . . . . . . . . . . . . 8.1 t70 -73.23 -31.73 64.32 Favored 'General case' 0 CA--C 1.539 0.54 0 CA-C-N 116.19 -0.459 . . . . 0.0 110.603 179.117 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' CYS . . . . . 0.435 ' HB2' ' O ' ' A' ' 45' ' ' SER . 7.6 t -58.94 -40.8 85.76 Favored 'General case' 0 N--CA 1.473 0.72 0 CA-C-N 115.929 -0.578 . . . . 0.0 110.374 179.079 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' MET . . . . . . . . . . . . . 74.0 mtm -84.03 -34.21 24.33 Favored 'General case' 0 C--O 1.238 0.453 0 O-C-N 123.627 0.579 . . . . 0.0 110.533 178.183 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ARG . . . . . . . . . . . . . 67.3 ttt180 -54.6 -38.14 66.42 Favored 'General case' 0 N--CA 1.476 0.825 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.705 178.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' THR . . . . . 0.439 ' HB ' ' HZ ' ' A' ' 43' ' ' PHE . 11.5 m -100.37 -48.04 4.71 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 115.747 -0.661 . . . . 0.0 109.57 178.45 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' CYS . . . . . 0.482 ' HB2' ' CG ' ' A' ' 21' ' ' TYR . 0.0 OUTLIER -116.1 55.16 0.81 Allowed 'General case' 0 CA--C 1.543 0.697 0 N-CA-C 112.851 0.686 . . . . 0.0 112.851 -179.145 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' GLY . . . . . . . . . . . . . . . -103.19 -55.75 0.8 Allowed Glycine 0 C--N 1.335 0.475 0 C-N-CA 121.059 -0.591 . . . . 0.0 112.48 179.277 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLY . . . . . . . . . . . . . . . 140.78 57.3 0.04 OUTLIER Glycine 0 C--N 1.336 0.581 0 C-N-CA 121.415 -0.421 . . . . 0.0 112.453 179.983 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.028 0 CA-C-O 118.247 -0.883 . . . . 0.0 111.088 -179.963 . . . . . . . . 0 0 . 1 stop_ save_